Browse entries in the PDBbind-CN Database
HEADER 1AKQ_COMPLEX COMPND 1AKQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 147 PRO LYS ALA LEU ILE VAL TYR GLY SER THR THR GLY ASN SEQRES 2 A 147 THR GLU TYR THR ALA GLU THR ILE ALA ARG GLU LEU ALA SEQRES 3 A 147 ASP ALA GLY TYR GLU VAL ASP SER ARG ASP ALA ALA SER SEQRES 4 A 147 VAL GLU ALA GLY GLY LEU PHE GLU GLY PHE ASP LEU VAL SEQRES 5 A 147 LEU LEU GLY CYS SER THR TRP GLY ASP ASP SER ILE GLU SEQRES 6 A 147 LEU GLN ASP ASP PHE ILE PRO LEU PHE ASP SER LEU GLU SEQRES 7 A 147 GLU THR GLY ALA GLN GLY ARG LYS VAL ALA CYS PHE GLY SEQRES 8 A 147 CYS GLY ALA SER SER TYR GLU TYR PHE CYS GLY ALA VAL SEQRES 9 A 147 ASP ALA ILE GLU GLU LYS LEU LYS ASN LEU GLY ALA GLU SEQRES 10 A 147 ILE VAL GLN ASP GLY LEU ARG ILE ASP GLY ASP PRO ARG SEQRES 11 A 147 ALA ALA ARG ASP ASP ILE VAL GLY TRP ALA HIS ASP VAL SEQRES 12 A 147 ARG GLY ALA ILE HET FMN A 248 50 ATOM 1 N PRO A 2 50.871 26.801 42.554 1.00 14.47 N ATOM 2 CA PRO A 2 49.725 26.587 41.638 1.00 15.97 C ATOM 3 C PRO A 2 50.108 25.795 40.393 1.00 15.94 C ATOM 4 O PRO A 2 51.285 25.573 40.114 1.00 16.98 O ATOM 5 CB PRO A 2 49.177 27.952 41.219 1.00 17.18 C ATOM 6 CG PRO A 2 50.005 28.915 42.025 1.00 18.18 C ATOM 7 CD PRO A 2 51.227 28.213 42.541 1.00 15.74 C ATOM 8 HA PRO A 2 48.974 26.004 42.171 1.00 0.00 H ATOM 9 HD3 PRO A 2 52.077 28.388 41.882 1.00 0.00 H ATOM 10 HD2 PRO A 2 51.471 28.556 43.546 1.00 0.00 H ATOM 11 HG3 PRO A 2 49.417 29.286 42.864 1.00 0.00 H ATOM 12 HG2 PRO A 2 50.305 29.752 41.395 1.00 0.00 H ATOM 13 HB2 PRO A 2 49.314 28.117 40.150 1.00 0.00 H ATOM 14 HB3 PRO A 2 48.119 28.042 41.467 1.00 0.00 H ATOM 15 N LYS A 3 49.091 25.346 39.664 1.00 15.56 N ATOM 16 CA LYS A 3 49.330 24.567 38.438 1.00 17.26 C ATOM 17 C LYS A 3 48.976 25.408 37.206 1.00 17.20 C ATOM 18 O LYS A 3 47.826 25.874 37.122 1.00 17.48 O ATOM 19 CB LYS A 3 48.458 23.304 38.490 1.00 20.33 C ATOM 20 CG LYS A 3 49.145 22.143 37.809 1.00 35.62 C ATOM 21 CD LYS A 3 48.252 20.913 37.705 1.00 47.36 C ATOM 22 CE LYS A 3 48.907 19.886 36.778 1.00 54.28 C ATOM 23 NZ LYS A 3 50.197 19.398 37.360 1.00 63.20 N ATOM 24 HA LYS A 3 50.381 24.288 38.369 1.00 0.00 H ATOM 25 HB2 LYS A 3 48.267 23.045 39.531 1.00 0.00 H ATOM 26 HB3 LYS A 3 47.511 23.503 37.987 1.00 0.00 H ATOM 27 HG2 LYS A 3 49.436 22.450 36.804 1.00 0.00 H ATOM 28 HG3 LYS A 3 50.036 21.881 38.380 1.00 0.00 H ATOM 29 HD2 LYS A 3 48.117 20.476 38.695 1.00 0.00 H ATOM 30 HD3 LYS A 3 47.281 21.201 37.301 1.00 0.00 H ATOM 31 HE2 LYS A 3 49.103 20.349 35.811 1.00 0.00 H ATOM 32 HE3 LYS A 3 48.231 19.041 36.645 1.00 0.00 H ATOM 33 HZ1 LYS A 3 50.845 20.201 37.485 1.00 0.00 H ATOM 34 HZ2 LYS A 3 50.013 18.952 38.282 1.00 0.00 H ATOM 35 HZ3 LYS A 3 50.625 18.702 36.716 1.00 0.00 H ATOM 36 H LYS A 3 48.116 25.547 39.963 1.00 0.00 H ATOM 37 N ALA A 4 49.928 25.614 36.290 1.00 15.32 N ATOM 38 CA ALA A 4 49.615 26.429 35.103 1.00 11.28 C ATOM 39 C ALA A 4 49.771 25.626 33.819 1.00 12.22 C ATOM 40 O ALA A 4 50.611 24.732 33.670 1.00 13.21 O ATOM 41 CB ALA A 4 50.567 27.612 35.089 1.00 11.68 C ATOM 42 HA ALA A 4 48.578 26.761 35.155 1.00 0.00 H ATOM 43 HB1 ALA A 4 50.430 28.198 35.998 1.00 0.00 H ATOM 44 HB2 ALA A 4 51.594 27.250 35.040 1.00 0.00 H ATOM 45 HB3 ALA A 4 50.358 28.235 34.219 1.00 0.00 H ATOM 46 H ALA A 4 50.876 25.205 36.414 1.00 0.00 H ATOM 47 N LEU A 5 48.913 25.933 32.854 1.00 12.50 N ATOM 48 CA LEU A 5 48.980 25.260 31.551 1.00 11.88 C ATOM 49 C LEU A 5 49.347 26.384 30.550 1.00 10.30 C ATOM 50 O LEU A 5 48.754 27.441 30.585 1.00 8.53 O ATOM 51 CB LEU A 5 47.650 24.740 31.099 1.00 16.42 C ATOM 52 CG LEU A 5 47.361 23.717 30.007 1.00 20.66 C ATOM 53 CD1 LEU A 5 46.245 24.274 29.128 1.00 15.11 C ATOM 54 CD2 LEU A 5 48.538 23.146 29.265 1.00 15.28 C ATOM 55 HA LEU A 5 49.676 24.424 31.611 1.00 0.00 H ATOM 56 HB2 LEU A 5 47.199 24.318 31.997 1.00 0.00 H ATOM 57 HB3 LEU A 5 47.095 25.628 30.798 1.00 0.00 H ATOM 58 HG LEU A 5 47.026 22.803 30.498 1.00 0.00 H ATOM 59 HD21 LEU A 5 49.080 23.952 28.771 1.00 0.00 H ATOM 60 HD22 LEU A 5 49.199 22.640 29.969 1.00 0.00 H ATOM 61 HD23 LEU A 5 48.185 22.434 28.519 1.00 0.00 H ATOM 62 HD11 LEU A 5 45.355 24.441 29.735 1.00 0.00 H ATOM 63 HD12 LEU A 5 46.568 25.217 28.687 1.00 0.00 H ATOM 64 HD13 LEU A 5 46.017 23.560 28.336 1.00 0.00 H ATOM 65 H LEU A 5 48.186 26.657 33.023 1.00 0.00 H ATOM 66 N ILE A 6 50.332 26.152 29.705 1.00 12.00 N ATOM 67 CA ILE A 6 50.729 27.105 28.679 1.00 12.85 C ATOM 68 C ILE A 6 50.475 26.410 27.325 1.00 14.05 C ATOM 69 O ILE A 6 51.022 25.327 27.130 1.00 14.71 O ATOM 70 CB ILE A 6 52.181 27.567 28.744 1.00 11.49 C ATOM 71 CG1 ILE A 6 52.438 28.284 30.083 1.00 12.59 C ATOM 72 CG2 ILE A 6 52.461 28.568 27.615 1.00 13.04 C ATOM 73 CD1 ILE A 6 53.908 28.612 30.299 1.00 16.13 C ATOM 74 HA ILE A 6 50.146 28.014 28.826 1.00 0.00 H ATOM 75 HB ILE A 6 52.827 26.694 28.647 1.00 0.00 H ATOM 76 HG12 ILE A 6 51.867 29.212 30.097 1.00 0.00 H ATOM 77 HG13 ILE A 6 52.101 27.639 30.895 1.00 0.00 H ATOM 78 HD11 ILE A 6 54.489 27.690 30.296 1.00 0.00 H ATOM 79 HD12 ILE A 6 54.255 29.264 29.498 1.00 0.00 H ATOM 80 HD13 ILE A 6 54.029 29.116 31.258 1.00 0.00 H ATOM 81 HG21 ILE A 6 52.278 28.089 26.653 1.00 0.00 H ATOM 82 HG22 ILE A 6 51.803 29.430 27.724 1.00 0.00 H ATOM 83 HG23 ILE A 6 53.500 28.893 27.669 1.00 0.00 H ATOM 84 H ILE A 6 50.847 25.251 29.774 1.00 0.00 H ATOM 85 N VAL A 7 49.632 26.966 26.459 1.00 13.07 N ATOM 86 CA VAL A 7 49.369 26.385 25.134 1.00 14.51 C ATOM 87 C VAL A 7 49.777 27.452 24.099 1.00 11.68 C ATOM 88 O VAL A 7 49.382 28.623 24.199 1.00 11.80 O ATOM 89 CB VAL A 7 47.931 25.924 24.912 1.00 14.84 C ATOM 90 CG1 VAL A 7 47.820 25.288 23.528 1.00 16.67 C ATOM 91 CG2 VAL A 7 47.516 24.873 25.934 1.00 19.83 C ATOM 92 HA VAL A 7 49.951 25.469 25.036 1.00 0.00 H ATOM 93 HB VAL A 7 47.284 26.796 25.010 1.00 0.00 H ATOM 94 HG11 VAL A 7 48.092 26.022 22.769 1.00 0.00 H ATOM 95 HG12 VAL A 7 48.494 24.433 23.467 1.00 0.00 H ATOM 96 HG13 VAL A 7 46.795 24.956 23.363 1.00 0.00 H ATOM 97 HG21 VAL A 7 48.173 24.007 25.850 1.00 0.00 H ATOM 98 HG22 VAL A 7 47.593 25.293 26.937 1.00 0.00 H ATOM 99 HG23 VAL A 7 46.487 24.570 25.744 1.00 0.00 H ATOM 100 H VAL A 7 49.142 27.843 26.729 1.00 0.00 H ATOM 101 N TYR A 8 50.624 27.084 23.131 1.00 11.85 N ATOM 102 CA TYR A 8 51.059 28.067 22.148 1.00 11.04 C ATOM 103 C TYR A 8 51.026 27.524 20.711 1.00 11.32 C ATOM 104 O TYR A 8 51.158 26.343 20.448 1.00 10.91 O ATOM 105 CB TYR A 8 52.503 28.557 22.445 1.00 13.17 C ATOM 106 CG TYR A 8 53.508 27.423 22.407 1.00 15.70 C ATOM 107 CD1 TYR A 8 53.777 26.661 23.527 1.00 14.85 C ATOM 108 CD2 TYR A 8 54.154 27.080 21.214 1.00 18.58 C ATOM 109 CE1 TYR A 8 54.664 25.597 23.488 1.00 16.13 C ATOM 110 CE2 TYR A 8 55.045 26.023 21.147 1.00 18.24 C ATOM 111 CZ TYR A 8 55.292 25.296 22.294 1.00 19.05 C ATOM 112 OH TYR A 8 56.136 24.220 22.231 1.00 20.82 O ATOM 113 HA TYR A 8 50.353 28.893 22.228 1.00 0.00 H ATOM 114 HB3 TYR A 8 52.523 29.012 23.435 1.00 0.00 H ATOM 115 HB2 TYR A 8 52.783 29.300 21.699 1.00 0.00 H ATOM 116 HD2 TYR A 8 53.950 27.660 20.314 1.00 0.00 H ATOM 117 HE2 TYR A 8 55.540 25.770 20.210 1.00 0.00 H ATOM 118 HE1 TYR A 8 54.863 25.008 24.383 1.00 0.00 H ATOM 119 HD1 TYR A 8 53.279 26.903 24.466 1.00 0.00 H ATOM 120 HH TYR A 8 56.210 23.807 23.128 1.00 0.00 H ATOM 121 H TYR A 8 50.969 26.104 23.081 1.00 0.00 H ATOM 122 N GLY A 9 50.843 28.447 19.771 1.00 12.03 N ATOM 123 CA GLY A 9 50.845 28.144 18.332 1.00 10.91 C ATOM 124 C GLY A 9 51.962 29.054 17.790 1.00 9.52 C ATOM 125 O GLY A 9 51.932 30.276 17.951 1.00 10.34 O ATOM 126 HA3 GLY A 9 49.885 28.389 17.878 1.00 0.00 H ATOM 127 HA2 GLY A 9 51.073 27.093 18.153 1.00 0.00 H ATOM 128 H GLY A 9 50.691 29.432 20.068 1.00 0.00 H ATOM 129 N SER A 10 52.943 28.450 17.138 1.00 10.14 N ATOM 130 CA SER A 10 54.064 29.206 16.615 1.00 11.00 C ATOM 131 C SER A 10 54.523 28.618 15.279 1.00 12.31 C ATOM 132 O SER A 10 54.754 27.407 15.252 1.00 11.22 O ATOM 133 CB SER A 10 55.233 29.026 17.607 1.00 6.53 C ATOM 134 OG SER A 10 56.248 29.966 17.304 1.00 9.53 O ATOM 135 HA SER A 10 53.774 30.248 16.482 1.00 0.00 H ATOM 136 HB2 SER A 10 55.633 28.016 17.520 1.00 0.00 H ATOM 137 HB3 SER A 10 54.877 29.188 18.624 1.00 0.00 H ATOM 138 HG SER A 10 55.882 30.882 17.383 1.00 0.00 H ATOM 139 H SER A 10 52.909 27.420 16.999 1.00 0.00 H ATOM 140 N THR A 11 54.640 29.425 14.248 1.00 11.18 N ATOM 141 CA THR A 11 55.078 28.944 12.925 1.00 13.54 C ATOM 142 C THR A 11 56.590 29.081 12.796 1.00 12.42 C ATOM 143 O THR A 11 57.236 28.123 12.323 1.00 15.03 O ATOM 144 CB THR A 11 54.328 29.698 11.799 1.00 12.40 C ATOM 145 OG1 THR A 11 52.974 29.241 11.821 1.00 13.22 O ATOM 146 CG2 THR A 11 54.919 29.515 10.415 1.00 12.10 C ATOM 147 HA THR A 11 54.831 27.887 12.825 1.00 0.00 H ATOM 148 HB THR A 11 54.412 30.767 11.996 1.00 0.00 H ATOM 149 HG1 THR A 11 52.460 29.702 11.112 1.00 0.00 H ATOM 150 HG23 THR A 11 55.951 29.867 10.412 1.00 0.00 H ATOM 151 HG21 THR A 11 54.894 28.459 10.147 1.00 0.00 H ATOM 152 HG22 THR A 11 54.336 30.088 9.694 1.00 0.00 H ATOM 153 H THR A 11 54.417 30.434 14.369 1.00 0.00 H ATOM 154 N THR A 12 57.185 30.191 13.197 1.00 10.13 N ATOM 155 CA THR A 12 58.630 30.343 13.089 1.00 12.10 C ATOM 156 C THR A 12 59.381 30.196 14.416 1.00 15.61 C ATOM 157 O THR A 12 60.611 30.367 14.419 1.00 13.84 O ATOM 158 CB THR A 12 59.055 31.614 12.341 1.00 13.15 C ATOM 159 OG1 THR A 12 58.865 32.797 13.107 1.00 17.20 O ATOM 160 CG2 THR A 12 58.250 31.802 11.047 1.00 16.78 C ATOM 161 HA THR A 12 58.934 29.494 12.476 1.00 0.00 H ATOM 162 HB THR A 12 60.115 31.471 12.133 1.00 0.00 H ATOM 163 HG1 THR A 12 57.907 32.889 13.338 1.00 0.00 H ATOM 164 HG23 THR A 12 58.362 30.918 10.419 1.00 0.00 H ATOM 165 HG21 THR A 12 57.198 31.944 11.293 1.00 0.00 H ATOM 166 HG22 THR A 12 58.621 32.677 10.514 1.00 0.00 H ATOM 167 H THR A 12 56.615 30.965 13.594 1.00 0.00 H ATOM 168 N GLY A 13 58.683 29.888 15.517 1.00 14.13 N ATOM 169 CA GLY A 13 59.362 29.692 16.804 1.00 11.47 C ATOM 170 C GLY A 13 59.384 30.909 17.693 1.00 11.02 C ATOM 171 O GLY A 13 59.905 30.792 18.795 1.00 11.95 O ATOM 172 HA3 GLY A 13 60.392 29.398 16.604 1.00 0.00 H ATOM 173 HA2 GLY A 13 58.854 28.889 17.338 1.00 0.00 H ATOM 174 H GLY A 13 57.650 29.787 15.460 1.00 0.00 H ATOM 175 N ASN A 14 58.874 32.061 17.277 1.00 11.64 N ATOM 176 CA ASN A 14 58.910 33.258 18.137 1.00 11.88 C ATOM 177 C ASN A 14 57.964 33.171 19.339 1.00 13.33 C ATOM 178 O ASN A 14 58.342 33.494 20.466 1.00 12.45 O ATOM 179 CB ASN A 14 58.620 34.530 17.341 1.00 6.43 C ATOM 180 CG ASN A 14 59.803 34.938 16.480 1.00 12.03 C ATOM 181 OD1 ASN A 14 60.946 34.534 16.692 1.00 14.60 O ATOM 182 ND2 ASN A 14 59.577 35.775 15.482 1.00 11.10 N ATOM 183 HA ASN A 14 59.927 33.302 18.528 1.00 0.00 H ATOM 184 HB2 ASN A 14 57.758 34.355 16.697 1.00 0.00 H ATOM 185 HB3 ASN A 14 58.394 35.338 18.037 1.00 0.00 H ATOM 186 HD22 ASN A 14 58.612 36.119 15.300 1.00 0.00 H ATOM 187 HD21 ASN A 14 60.364 36.090 14.879 1.00 0.00 H ATOM 188 H ASN A 14 58.443 32.120 16.332 1.00 0.00 H ATOM 189 N THR A 15 56.732 32.737 19.131 1.00 9.80 N ATOM 190 CA THR A 15 55.766 32.584 20.211 1.00 8.64 C ATOM 191 C THR A 15 56.179 31.375 21.045 1.00 11.12 C ATOM 192 O THR A 15 55.907 31.369 22.232 1.00 11.90 O ATOM 193 CB THR A 15 54.331 32.402 19.726 1.00 10.26 C ATOM 194 OG1 THR A 15 54.026 33.564 18.925 1.00 11.48 O ATOM 195 CG2 THR A 15 53.377 32.337 20.905 1.00 10.87 C ATOM 196 HA THR A 15 55.774 33.504 20.795 1.00 0.00 H ATOM 197 HB THR A 15 54.225 31.477 19.159 1.00 0.00 H ATOM 198 HG1 THR A 15 54.656 33.613 18.163 1.00 0.00 H ATOM 199 HG23 THR A 15 53.608 31.460 21.509 1.00 0.00 H ATOM 200 HG21 THR A 15 53.488 33.236 21.511 1.00 0.00 H ATOM 201 HG22 THR A 15 52.353 32.268 20.539 1.00 0.00 H ATOM 202 H THR A 15 56.442 32.496 18.162 1.00 0.00 H ATOM 203 N GLU A 16 56.825 30.377 20.449 1.00 11.42 N ATOM 204 CA GLU A 16 57.321 29.236 21.199 1.00 11.33 C ATOM 205 C GLU A 16 58.442 29.691 22.153 1.00 12.43 C ATOM 206 O GLU A 16 58.505 29.277 23.316 1.00 12.70 O ATOM 207 CB GLU A 16 57.891 28.169 20.268 1.00 12.25 C ATOM 208 CG GLU A 16 58.605 27.069 21.026 1.00 20.91 C ATOM 209 CD GLU A 16 59.103 25.966 20.115 1.00 31.49 C ATOM 210 OE1 GLU A 16 59.342 26.187 18.913 1.00 38.65 O ATOM 211 OE2 GLU A 16 59.268 24.851 20.635 1.00 40.26 O ATOM 212 HA GLU A 16 56.485 28.816 21.757 1.00 0.00 H ATOM 213 HB2 GLU A 16 57.074 27.728 19.697 1.00 0.00 H ATOM 214 HB3 GLU A 16 58.597 28.640 19.585 1.00 0.00 H ATOM 215 HG2 GLU A 16 59.457 27.502 21.550 1.00 0.00 H ATOM 216 HG3 GLU A 16 57.914 26.639 21.751 1.00 0.00 H ATOM 217 H GLU A 16 56.979 30.414 19.421 1.00 0.00 H ATOM 218 N TYR A 17 59.359 30.552 21.706 1.00 11.95 N ATOM 219 CA TYR A 17 60.433 31.074 22.509 1.00 10.40 C ATOM 220 C TYR A 17 59.772 31.848 23.657 1.00 11.36 C ATOM 221 O TYR A 17 60.231 31.763 24.794 1.00 11.97 O ATOM 222 CB TYR A 17 61.358 32.016 21.732 1.00 9.57 C ATOM 223 CG TYR A 17 62.262 32.839 22.619 1.00 10.23 C ATOM 224 CD1 TYR A 17 63.488 32.346 23.086 1.00 11.98 C ATOM 225 CD2 TYR A 17 61.889 34.104 23.030 1.00 10.43 C ATOM 226 CE1 TYR A 17 64.282 33.109 23.925 1.00 12.47 C ATOM 227 CE2 TYR A 17 62.668 34.877 23.883 1.00 10.36 C ATOM 228 CZ TYR A 17 63.873 34.364 24.320 1.00 13.22 C ATOM 229 OH TYR A 17 64.661 35.149 25.131 1.00 14.44 O ATOM 230 HA TYR A 17 61.057 30.250 22.854 1.00 0.00 H ATOM 231 HB3 TYR A 17 60.743 32.695 21.141 1.00 0.00 H ATOM 232 HB2 TYR A 17 61.979 31.418 21.066 1.00 0.00 H ATOM 233 HD2 TYR A 17 60.945 34.513 22.671 1.00 0.00 H ATOM 234 HE2 TYR A 17 62.335 35.865 24.200 1.00 0.00 H ATOM 235 HE1 TYR A 17 65.236 32.715 24.275 1.00 0.00 H ATOM 236 HD1 TYR A 17 63.820 31.352 22.786 1.00 0.00 H ATOM 237 HH TYR A 17 65.487 34.656 25.364 1.00 0.00 H ATOM 238 H TYR A 17 59.293 30.865 20.716 1.00 0.00 H ATOM 239 N THR A 18 58.743 32.625 23.400 1.00 8.23 N ATOM 240 CA THR A 18 58.030 33.419 24.373 1.00 9.96 C ATOM 241 C THR A 18 57.423 32.525 25.455 1.00 12.43 C ATOM 242 O THR A 18 57.580 32.794 26.659 1.00 13.33 O ATOM 243 CB THR A 18 56.967 34.284 23.682 1.00 10.55 C ATOM 244 OG1 THR A 18 57.658 35.135 22.751 1.00 10.66 O ATOM 245 CG2 THR A 18 56.267 35.215 24.650 1.00 9.37 C ATOM 246 HA THR A 18 58.733 34.092 24.864 1.00 0.00 H ATOM 247 HB THR A 18 56.233 33.620 23.225 1.00 0.00 H ATOM 248 HG1 THR A 18 58.139 34.577 22.090 1.00 0.00 H ATOM 249 HG23 THR A 18 55.721 34.627 25.387 1.00 0.00 H ATOM 250 HG21 THR A 18 57.007 35.836 25.155 1.00 0.00 H ATOM 251 HG22 THR A 18 55.571 35.850 24.102 1.00 0.00 H ATOM 252 H THR A 18 58.415 32.672 22.414 1.00 0.00 H ATOM 253 N ALA A 19 56.747 31.465 25.062 1.00 8.75 N ATOM 254 CA ALA A 19 56.126 30.493 25.926 1.00 10.32 C ATOM 255 C ALA A 19 57.143 29.805 26.835 1.00 14.51 C ATOM 256 O ALA A 19 56.886 29.604 28.032 1.00 12.29 O ATOM 257 CB ALA A 19 55.429 29.421 25.077 1.00 9.02 C ATOM 258 HA ALA A 19 55.407 31.024 26.550 1.00 0.00 H ATOM 259 HB1 ALA A 19 54.668 29.891 24.454 1.00 0.00 H ATOM 260 HB2 ALA A 19 56.165 28.926 24.443 1.00 0.00 H ATOM 261 HB3 ALA A 19 54.960 28.688 25.733 1.00 0.00 H ATOM 262 H ALA A 19 56.653 31.316 24.037 1.00 0.00 H ATOM 263 N GLU A 20 58.310 29.417 26.334 1.00 12.89 N ATOM 264 CA GLU A 20 59.330 28.764 27.144 1.00 15.95 C ATOM 265 C GLU A 20 59.973 29.729 28.138 1.00 13.38 C ATOM 266 O GLU A 20 60.382 29.284 29.229 1.00 13.71 O ATOM 267 CB GLU A 20 60.317 27.903 26.360 1.00 27.03 C ATOM 268 CG GLU A 20 60.784 28.262 24.992 1.00 50.42 C ATOM 269 CD GLU A 20 61.512 27.282 24.094 1.00 57.24 C ATOM 270 OE1 GLU A 20 61.209 26.064 24.113 1.00 57.19 O ATOM 271 OE2 GLU A 20 62.405 27.732 23.312 1.00 59.35 O ATOM 272 HA GLU A 20 58.802 28.023 27.745 1.00 0.00 H ATOM 273 HB2 GLU A 20 61.213 27.832 26.977 1.00 0.00 H ATOM 274 HB3 GLU A 20 59.858 26.918 26.274 1.00 0.00 H ATOM 275 HG2 GLU A 20 59.896 28.575 24.442 1.00 0.00 H ATOM 276 HG3 GLU A 20 61.453 29.114 25.115 1.00 0.00 H ATOM 277 H GLU A 20 58.503 29.585 25.326 1.00 0.00 H ATOM 278 N THR A 21 60.078 31.010 27.874 1.00 10.66 N ATOM 279 CA THR A 21 60.624 32.044 28.751 1.00 10.74 C ATOM 280 C THR A 21 59.638 32.246 29.907 1.00 12.59 C ATOM 281 O THR A 21 60.034 32.342 31.072 1.00 11.44 O ATOM 282 CB THR A 21 60.817 33.350 27.982 1.00 11.70 C ATOM 283 OG1 THR A 21 61.824 33.105 26.963 1.00 11.58 O ATOM 284 CG2 THR A 21 61.227 34.529 28.858 1.00 10.13 C ATOM 285 HA THR A 21 61.598 31.739 29.133 1.00 0.00 H ATOM 286 HB THR A 21 59.858 33.637 27.550 1.00 0.00 H ATOM 287 HG1 THR A 21 62.670 32.828 27.396 1.00 0.00 H ATOM 288 HG23 THR A 21 60.463 34.700 29.616 1.00 0.00 H ATOM 289 HG21 THR A 21 62.178 34.307 29.342 1.00 0.00 H ATOM 290 HG22 THR A 21 61.333 35.420 28.239 1.00 0.00 H ATOM 291 H THR A 21 59.737 31.323 26.943 1.00 0.00 H ATOM 292 N ILE A 22 58.354 32.318 29.597 1.00 8.92 N ATOM 293 CA ILE A 22 57.312 32.455 30.594 1.00 11.00 C ATOM 294 C ILE A 22 57.261 31.171 31.416 1.00 12.70 C ATOM 295 O ILE A 22 57.152 31.238 32.647 1.00 14.50 O ATOM 296 CB ILE A 22 55.935 32.660 29.940 1.00 12.01 C ATOM 297 CG1 ILE A 22 55.916 33.999 29.208 1.00 9.98 C ATOM 298 CG2 ILE A 22 54.856 32.519 31.009 1.00 10.89 C ATOM 299 CD1 ILE A 22 54.752 34.199 28.268 1.00 8.93 C ATOM 300 HA ILE A 22 57.538 33.322 31.214 1.00 0.00 H ATOM 301 HB ILE A 22 55.730 31.900 29.186 1.00 0.00 H ATOM 302 HG12 ILE A 22 55.887 34.792 29.955 1.00 0.00 H ATOM 303 HG13 ILE A 22 56.836 34.081 28.629 1.00 0.00 H ATOM 304 HD11 ILE A 22 54.769 33.425 27.501 1.00 0.00 H ATOM 305 HD12 ILE A 22 53.819 34.137 28.828 1.00 0.00 H ATOM 306 HD13 ILE A 22 54.830 35.179 27.798 1.00 0.00 H ATOM 307 HG21 ILE A 22 54.911 31.524 31.450 1.00 0.00 H ATOM 308 HG22 ILE A 22 55.013 33.270 31.783 1.00 0.00 H ATOM 309 HG23 ILE A 22 53.876 32.663 30.555 1.00 0.00 H ATOM 310 H ILE A 22 58.081 32.274 28.594 1.00 0.00 H ATOM 311 N ALA A 23 57.372 29.994 30.823 1.00 10.67 N ATOM 312 CA ALA A 23 57.337 28.721 31.523 1.00 12.19 C ATOM 313 C ALA A 23 58.449 28.622 32.575 1.00 14.81 C ATOM 314 O ALA A 23 58.197 28.168 33.681 1.00 14.31 O ATOM 315 CB ALA A 23 57.464 27.511 30.614 1.00 7.71 C ATOM 316 HA ALA A 23 56.352 28.704 31.990 1.00 0.00 H ATOM 317 HB1 ALA A 23 56.642 27.508 29.899 1.00 0.00 H ATOM 318 HB2 ALA A 23 58.412 27.558 30.079 1.00 0.00 H ATOM 319 HB3 ALA A 23 57.429 26.602 31.214 1.00 0.00 H ATOM 320 H ALA A 23 57.492 29.979 29.790 1.00 0.00 H ATOM 321 N ARG A 24 59.650 29.018 32.208 1.00 11.94 N ATOM 322 CA ARG A 24 60.808 29.008 33.074 1.00 14.23 C ATOM 323 C ARG A 24 60.602 29.989 34.218 1.00 13.94 C ATOM 324 O ARG A 24 60.918 29.598 35.364 1.00 14.92 O ATOM 325 CB ARG A 24 62.049 29.257 32.226 1.00 16.82 C ATOM 326 CG ARG A 24 63.392 29.381 32.896 1.00 34.91 C ATOM 327 CD ARG A 24 63.550 28.508 34.119 1.00 51.72 C ATOM 328 NE ARG A 24 64.749 27.681 34.120 1.00 75.85 N ATOM 329 CZ ARG A 24 64.852 26.569 33.390 1.00 89.92 C ATOM 330 NH1 ARG A 24 63.834 26.180 32.624 1.00 98.41 N ATOM 331 NH2 ARG A 24 65.972 25.854 33.431 1.00 95.21 N ATOM 332 HA ARG A 24 60.953 28.040 33.553 1.00 0.00 H ATOM 333 HB2 ARG A 24 62.122 28.430 31.520 1.00 0.00 H ATOM 334 HB3 ARG A 24 61.880 30.185 31.680 1.00 0.00 H ATOM 335 HG2 ARG A 24 64.162 29.105 32.175 1.00 0.00 H ATOM 336 HG3 ARG A 24 63.532 30.420 33.195 1.00 0.00 H ATOM 337 HD2 ARG A 24 62.683 27.851 34.183 1.00 0.00 H ATOM 338 HD3 ARG A 24 63.581 29.154 34.997 1.00 0.00 H ATOM 339 HE ARG A 24 65.555 27.968 34.712 1.00 0.00 H ATOM 340 HH12 ARG A 24 63.913 25.313 32.055 1.00 0.00 H ATOM 341 HH11 ARG A 24 62.960 26.743 32.595 1.00 0.00 H ATOM 342 HH22 ARG A 24 66.056 24.987 32.863 1.00 0.00 H ATOM 343 HH21 ARG A 24 66.764 26.162 34.031 1.00 0.00 H ATOM 344 H ARG A 24 59.774 29.360 31.234 1.00 0.00 H ATOM 345 N GLU A 25 60.074 31.192 34.041 1.00 10.98 N ATOM 346 CA GLU A 25 59.844 32.109 35.149 1.00 14.26 C ATOM 347 C GLU A 25 58.845 31.561 36.167 1.00 14.81 C ATOM 348 O GLU A 25 59.082 31.711 37.365 1.00 14.64 O ATOM 349 CB GLU A 25 59.343 33.491 34.709 1.00 15.93 C ATOM 350 CG GLU A 25 60.411 34.225 33.915 1.00 22.90 C ATOM 351 CD GLU A 25 61.596 34.483 34.846 1.00 26.10 C ATOM 352 OE1 GLU A 25 61.308 35.218 35.806 1.00 25.38 O ATOM 353 OE2 GLU A 25 62.692 33.948 34.595 1.00 27.01 O ATOM 354 HA GLU A 25 60.828 32.214 35.605 1.00 0.00 H ATOM 355 HB2 GLU A 25 58.456 33.369 34.087 1.00 0.00 H ATOM 356 HB3 GLU A 25 59.088 34.077 35.592 1.00 0.00 H ATOM 357 HG2 GLU A 25 60.730 33.614 33.070 1.00 0.00 H ATOM 358 HG3 GLU A 25 60.015 35.172 33.548 1.00 0.00 H ATOM 359 H GLU A 25 59.815 31.491 33.079 1.00 0.00 H ATOM 360 N LEU A 26 57.755 30.958 35.723 1.00 14.55 N ATOM 361 CA LEU A 26 56.748 30.373 36.601 1.00 14.93 C ATOM 362 C LEU A 26 57.289 29.165 37.351 1.00 15.45 C ATOM 363 O LEU A 26 57.010 29.054 38.550 1.00 16.38 O ATOM 364 CB LEU A 26 55.533 29.921 35.805 1.00 17.33 C ATOM 365 CG LEU A 26 54.334 30.852 35.695 1.00 22.41 C ATOM 366 CD1 LEU A 26 54.679 32.306 35.721 1.00 20.15 C ATOM 367 CD2 LEU A 26 53.534 30.483 34.440 1.00 18.79 C ATOM 368 HA LEU A 26 56.469 31.150 37.313 1.00 0.00 H ATOM 369 HB2 LEU A 26 55.874 29.717 34.790 1.00 0.00 H ATOM 370 HB3 LEU A 26 55.179 28.996 36.260 1.00 0.00 H ATOM 371 HG LEU A 26 53.726 30.704 36.587 1.00 0.00 H ATOM 372 HD21 LEU A 26 54.169 30.593 33.561 1.00 0.00 H ATOM 373 HD22 LEU A 26 53.194 29.450 34.518 1.00 0.00 H ATOM 374 HD23 LEU A 26 52.672 31.145 34.352 1.00 0.00 H ATOM 375 HD11 LEU A 26 55.182 32.542 36.659 1.00 0.00 H ATOM 376 HD12 LEU A 26 55.340 32.536 34.885 1.00 0.00 H ATOM 377 HD13 LEU A 26 53.766 32.896 35.638 1.00 0.00 H ATOM 378 H LEU A 26 57.608 30.898 34.695 1.00 0.00 H ATOM 379 N ALA A 27 58.029 28.268 36.720 1.00 12.24 N ATOM 380 CA ALA A 27 58.600 27.093 37.352 1.00 11.53 C ATOM 381 C ALA A 27 59.646 27.501 38.390 1.00 14.11 C ATOM 382 O ALA A 27 59.775 26.900 39.463 1.00 13.36 O ATOM 383 CB ALA A 27 59.217 26.187 36.303 1.00 10.97 C ATOM 384 HA ALA A 27 57.806 26.547 37.862 1.00 0.00 H ATOM 385 HB1 ALA A 27 58.448 25.876 35.596 1.00 0.00 H ATOM 386 HB2 ALA A 27 60.002 26.728 35.774 1.00 0.00 H ATOM 387 HB3 ALA A 27 59.642 25.309 36.788 1.00 0.00 H ATOM 388 H ALA A 27 58.213 28.414 35.707 1.00 0.00 H ATOM 389 N ASP A 28 60.427 28.539 38.133 1.00 13.77 N ATOM 390 CA ASP A 28 61.448 29.046 39.050 1.00 14.39 C ATOM 391 C ASP A 28 60.810 29.573 40.340 1.00 13.38 C ATOM 392 O ASP A 28 61.447 29.565 41.377 1.00 15.39 O ATOM 393 CB ASP A 28 62.287 30.181 38.467 1.00 11.60 C ATOM 394 CG ASP A 28 63.430 29.658 37.607 1.00 16.43 C ATOM 395 OD1 ASP A 28 63.682 28.434 37.505 1.00 15.78 O ATOM 396 OD2 ASP A 28 64.075 30.529 36.991 1.00 17.61 O ATOM 397 HA ASP A 28 62.099 28.193 39.242 1.00 0.00 H ATOM 398 HB2 ASP A 28 61.646 30.815 37.854 1.00 0.00 H ATOM 399 HB3 ASP A 28 62.702 30.769 39.285 1.00 0.00 H ATOM 400 H ASP A 28 60.307 29.025 37.221 1.00 0.00 H ATOM 401 N ALA A 29 59.580 30.038 40.277 1.00 11.47 N ATOM 402 CA ALA A 29 58.808 30.543 41.377 1.00 11.74 C ATOM 403 C ALA A 29 58.107 29.390 42.106 1.00 13.99 C ATOM 404 O ALA A 29 57.464 29.642 43.133 1.00 15.67 O ATOM 405 CB ALA A 29 57.758 31.546 40.908 1.00 12.30 C ATOM 406 HA ALA A 29 59.496 31.048 42.055 1.00 0.00 H ATOM 407 HB1 ALA A 29 58.252 32.385 40.418 1.00 0.00 H ATOM 408 HB2 ALA A 29 57.082 31.060 40.205 1.00 0.00 H ATOM 409 HB3 ALA A 29 57.193 31.907 41.767 1.00 0.00 H ATOM 410 H ALA A 29 59.125 30.040 39.342 1.00 0.00 H ATOM 411 N GLY A 30 58.200 28.152 41.623 1.00 11.93 N ATOM 412 CA GLY A 30 57.561 27.027 42.268 1.00 13.24 C ATOM 413 C GLY A 30 56.269 26.562 41.616 1.00 15.44 C ATOM 414 O GLY A 30 55.687 25.589 42.113 1.00 14.73 O ATOM 415 HA3 GLY A 30 57.339 27.308 43.297 1.00 0.00 H ATOM 416 HA2 GLY A 30 58.262 26.192 42.264 1.00 0.00 H ATOM 417 H GLY A 30 58.749 27.990 40.755 1.00 0.00 H ATOM 418 N TYR A 31 55.754 27.178 40.543 1.00 14.26 N ATOM 419 CA TYR A 31 54.514 26.656 39.970 1.00 12.96 C ATOM 420 C TYR A 31 54.752 25.319 39.276 1.00 11.66 C ATOM 421 O TYR A 31 55.884 25.044 38.868 1.00 14.03 O ATOM 422 CB TYR A 31 54.091 27.542 38.798 1.00 13.09 C ATOM 423 CG TYR A 31 53.366 28.780 39.181 1.00 14.67 C ATOM 424 CD1 TYR A 31 53.783 29.613 40.204 1.00 18.49 C ATOM 425 CD2 TYR A 31 52.186 29.070 38.498 1.00 16.38 C ATOM 426 CE1 TYR A 31 53.047 30.737 40.534 1.00 19.09 C ATOM 427 CE2 TYR A 31 51.456 30.202 38.819 1.00 17.16 C ATOM 428 CZ TYR A 31 51.894 31.017 39.826 1.00 22.05 C ATOM 429 OH TYR A 31 51.143 32.136 40.122 1.00 30.84 O ATOM 430 HA TYR A 31 53.797 26.597 40.788 1.00 0.00 H ATOM 431 HB3 TYR A 31 53.442 26.956 38.147 1.00 0.00 H ATOM 432 HB2 TYR A 31 54.988 27.830 38.250 1.00 0.00 H ATOM 433 HD2 TYR A 31 51.837 28.404 37.709 1.00 0.00 H ATOM 434 HE2 TYR A 31 50.542 30.441 38.275 1.00 0.00 H ATOM 435 HE1 TYR A 31 53.372 31.393 41.342 1.00 0.00 H ATOM 436 HD1 TYR A 31 54.696 29.382 40.753 1.00 0.00 H ATOM 437 HH TYR A 31 51.571 32.632 40.864 1.00 0.00 H ATOM 438 H TYR A 31 56.225 28.007 40.128 1.00 0.00 H ATOM 439 N GLU A 32 53.711 24.508 39.140 1.00 13.79 N ATOM 440 CA GLU A 32 53.879 23.263 38.362 1.00 17.32 C ATOM 441 C GLU A 32 53.389 23.760 36.969 1.00 15.84 C ATOM 442 O GLU A 32 52.295 24.286 36.812 1.00 17.24 O ATOM 443 CB GLU A 32 53.202 22.001 38.786 1.00 27.17 C ATOM 444 CG GLU A 32 52.188 22.174 39.899 1.00 54.25 C ATOM 445 CD GLU A 32 52.101 20.928 40.776 1.00 61.96 C ATOM 446 OE1 GLU A 32 51.270 20.062 40.425 1.00 64.23 O ATOM 447 OE2 GLU A 32 52.859 20.866 41.772 1.00 68.28 O ATOM 448 HA GLU A 32 54.901 22.896 38.459 1.00 0.00 H ATOM 449 HB2 GLU A 32 52.689 21.582 37.920 1.00 0.00 H ATOM 450 HB3 GLU A 32 53.966 21.303 39.127 1.00 0.00 H ATOM 451 HG2 GLU A 32 52.481 23.023 40.517 1.00 0.00 H ATOM 452 HG3 GLU A 32 51.209 22.367 39.460 1.00 0.00 H ATOM 453 H GLU A 32 52.795 24.744 39.572 1.00 0.00 H ATOM 454 N VAL A 33 54.275 23.667 35.992 1.00 16.03 N ATOM 455 CA VAL A 33 53.955 24.178 34.653 1.00 16.62 C ATOM 456 C VAL A 33 53.870 23.097 33.588 1.00 17.11 C ATOM 457 O VAL A 33 54.726 22.210 33.480 1.00 18.60 O ATOM 458 CB VAL A 33 54.985 25.259 34.266 1.00 17.05 C ATOM 459 CG1 VAL A 33 54.689 25.822 32.868 1.00 21.99 C ATOM 460 CG2 VAL A 33 54.994 26.420 35.252 1.00 15.84 C ATOM 461 HA VAL A 33 52.955 24.610 34.701 1.00 0.00 H ATOM 462 HB VAL A 33 55.960 24.771 34.280 1.00 0.00 H ATOM 463 HG11 VAL A 33 54.734 25.016 32.136 1.00 0.00 H ATOM 464 HG12 VAL A 33 53.694 26.266 32.860 1.00 0.00 H ATOM 465 HG13 VAL A 33 55.430 26.582 32.620 1.00 0.00 H ATOM 466 HG21 VAL A 33 54.007 26.883 35.275 1.00 0.00 H ATOM 467 HG22 VAL A 33 55.247 26.049 36.245 1.00 0.00 H ATOM 468 HG23 VAL A 33 55.734 27.156 34.938 1.00 0.00 H ATOM 469 H VAL A 33 55.202 23.231 36.172 1.00 0.00 H ATOM 470 N ASP A 34 52.791 23.180 32.805 1.00 16.28 N ATOM 471 CA ASP A 34 52.561 22.222 31.712 1.00 19.32 C ATOM 472 C ASP A 34 52.520 23.068 30.430 1.00 17.19 C ATOM 473 O ASP A 34 51.577 23.811 30.250 1.00 18.35 O ATOM 474 CB ASP A 34 51.267 21.493 32.018 1.00 25.66 C ATOM 475 CG ASP A 34 51.008 20.236 31.225 1.00 38.88 C ATOM 476 OD1 ASP A 34 51.666 20.019 30.181 1.00 43.32 O ATOM 477 OD2 ASP A 34 50.132 19.430 31.623 1.00 41.09 O ATOM 478 HA ASP A 34 53.329 21.457 31.595 1.00 0.00 H ATOM 479 HB2 ASP A 34 51.278 21.224 33.074 1.00 0.00 H ATOM 480 HB3 ASP A 34 50.444 22.182 31.828 1.00 0.00 H ATOM 481 H ASP A 34 52.099 23.938 32.971 1.00 0.00 H ATOM 482 N SER A 35 53.542 22.966 29.603 1.00 19.72 N ATOM 483 CA SER A 35 53.692 23.724 28.357 1.00 18.78 C ATOM 484 C SER A 35 53.481 22.838 27.138 1.00 20.39 C ATOM 485 O SER A 35 54.188 21.854 26.926 1.00 21.36 O ATOM 486 CB SER A 35 55.091 24.333 28.317 1.00 18.83 C ATOM 487 OG SER A 35 55.186 25.405 27.394 1.00 34.06 O ATOM 488 HA SER A 35 52.935 24.508 28.332 1.00 0.00 H ATOM 489 HB2 SER A 35 55.802 23.559 28.030 1.00 0.00 H ATOM 490 HB3 SER A 35 55.341 24.703 29.311 1.00 0.00 H ATOM 491 HG SER A 35 56.108 25.766 27.403 1.00 0.00 H ATOM 492 H SER A 35 54.298 22.298 29.853 1.00 0.00 H ATOM 493 N ARG A 36 52.484 23.129 26.309 1.00 16.52 N ATOM 494 CA ARG A 36 52.158 22.339 25.153 1.00 16.71 C ATOM 495 C ARG A 36 51.988 23.121 23.841 1.00 16.70 C ATOM 496 O ARG A 36 51.420 24.205 23.826 1.00 14.44 O ATOM 497 CB ARG A 36 50.777 21.677 25.402 1.00 19.52 C ATOM 498 CG ARG A 36 50.724 20.762 26.606 1.00 31.95 C ATOM 499 CD ARG A 36 49.357 20.127 26.794 1.00 38.62 C ATOM 500 NE ARG A 36 49.223 19.672 28.173 1.00 46.90 N ATOM 501 CZ ARG A 36 48.218 18.964 28.671 1.00 49.01 C ATOM 502 NH1 ARG A 36 47.215 18.605 27.882 1.00 51.25 N ATOM 503 NH2 ARG A 36 48.222 18.621 29.955 1.00 48.32 N ATOM 504 HA ARG A 36 52.997 21.654 25.033 1.00 0.00 H ATOM 505 HB2 ARG A 36 50.041 22.468 25.544 1.00 0.00 H ATOM 506 HB3 ARG A 36 50.516 21.093 24.519 1.00 0.00 H ATOM 507 HG2 ARG A 36 51.463 19.971 26.477 1.00 0.00 H ATOM 508 HG3 ARG A 36 50.966 21.342 27.497 1.00 0.00 H ATOM 509 HD2 ARG A 36 49.253 19.278 26.118 1.00 0.00 H ATOM 510 HD3 ARG A 36 48.581 20.861 26.575 1.00 0.00 H ATOM 511 HE ARG A 36 49.989 19.927 28.829 1.00 0.00 H ATOM 512 HH12 ARG A 36 46.424 18.050 28.266 1.00 0.00 H ATOM 513 HH11 ARG A 36 47.219 18.879 26.879 1.00 0.00 H ATOM 514 HH22 ARG A 36 47.435 18.066 30.347 1.00 0.00 H ATOM 515 HH21 ARG A 36 49.012 18.908 30.567 1.00 0.00 H ATOM 516 H ARG A 36 51.909 23.973 26.507 1.00 0.00 H ATOM 517 N ASP A 37 52.480 22.537 22.758 1.00 14.41 N ATOM 518 CA ASP A 37 52.297 23.143 21.430 1.00 13.87 C ATOM 519 C ASP A 37 50.828 22.903 21.102 1.00 12.40 C ATOM 520 O ASP A 37 50.311 21.787 21.308 1.00 14.62 O ATOM 521 CB ASP A 37 53.169 22.367 20.445 1.00 18.85 C ATOM 522 CG ASP A 37 53.260 22.960 19.053 1.00 18.14 C ATOM 523 OD1 ASP A 37 52.253 23.447 18.529 1.00 17.87 O ATOM 524 OD2 ASP A 37 54.394 22.958 18.537 1.00 24.26 O ATOM 525 HA ASP A 37 52.560 24.200 21.388 1.00 0.00 H ATOM 526 HB2 ASP A 37 54.177 22.315 20.856 1.00 0.00 H ATOM 527 HB3 ASP A 37 52.762 21.360 20.356 1.00 0.00 H ATOM 528 H ASP A 37 53.001 21.641 22.848 1.00 0.00 H ATOM 529 N ALA A 38 50.086 23.856 20.554 1.00 15.86 N ATOM 530 CA ALA A 38 48.682 23.695 20.197 1.00 15.13 C ATOM 531 C ALA A 38 48.460 22.563 19.188 1.00 17.15 C ATOM 532 O ALA A 38 47.341 22.048 19.083 1.00 16.52 O ATOM 533 CB ALA A 38 48.105 24.978 19.626 1.00 10.83 C ATOM 534 HA ALA A 38 48.168 23.440 21.124 1.00 0.00 H ATOM 535 HB1 ALA A 38 48.185 25.773 20.368 1.00 0.00 H ATOM 536 HB2 ALA A 38 48.660 25.258 18.731 1.00 0.00 H ATOM 537 HB3 ALA A 38 47.057 24.822 19.371 1.00 0.00 H ATOM 538 H ALA A 38 50.534 24.776 20.367 1.00 0.00 H ATOM 539 N ALA A 39 49.467 22.151 18.445 1.00 17.69 N ATOM 540 CA ALA A 39 49.356 21.075 17.469 1.00 23.44 C ATOM 541 C ALA A 39 49.070 19.715 18.113 1.00 28.32 C ATOM 542 O ALA A 39 48.422 18.844 17.503 1.00 31.03 O ATOM 543 CB ALA A 39 50.658 20.956 16.673 1.00 17.36 C ATOM 544 HA ALA A 39 48.517 21.332 16.822 1.00 0.00 H ATOM 545 HB1 ALA A 39 50.852 21.894 16.153 1.00 0.00 H ATOM 546 HB2 ALA A 39 51.481 20.740 17.355 1.00 0.00 H ATOM 547 HB3 ALA A 39 50.565 20.149 15.946 1.00 0.00 H ATOM 548 H ALA A 39 50.389 22.618 18.561 1.00 0.00 H ATOM 549 N SER A 40 49.521 19.527 19.349 1.00 26.75 N ATOM 550 CA SER A 40 49.346 18.260 20.047 1.00 27.43 C ATOM 551 C SER A 40 48.255 18.182 21.083 1.00 26.82 C ATOM 552 O SER A 40 48.137 17.224 21.847 1.00 31.77 O ATOM 553 CB SER A 40 50.696 18.046 20.783 1.00 26.91 C ATOM 554 OG SER A 40 50.668 18.830 21.983 1.00 35.52 O ATOM 555 HA SER A 40 49.056 17.518 19.302 1.00 0.00 H ATOM 556 HB2 SER A 40 51.521 18.369 20.148 1.00 0.00 H ATOM 557 HB3 SER A 40 50.821 16.992 21.031 1.00 0.00 H ATOM 558 HG SER A 40 50.550 19.785 21.749 1.00 0.00 H ATOM 559 H SER A 40 50.013 20.306 19.832 1.00 0.00 H ATOM 560 N VAL A 41 47.402 19.161 21.164 1.00 24.82 N ATOM 561 CA VAL A 41 46.326 19.292 22.124 1.00 26.55 C ATOM 562 C VAL A 41 44.944 18.998 21.593 1.00 29.12 C ATOM 563 O VAL A 41 44.654 19.169 20.413 1.00 29.70 O ATOM 564 CB VAL A 41 46.473 20.779 22.569 1.00 27.09 C ATOM 565 CG1 VAL A 41 45.190 21.525 22.742 1.00 26.86 C ATOM 566 CG2 VAL A 41 47.368 20.840 23.800 1.00 22.30 C ATOM 567 HA VAL A 41 46.412 18.558 22.925 1.00 0.00 H ATOM 568 HB VAL A 41 46.945 21.314 21.745 1.00 0.00 H ATOM 569 HG11 VAL A 41 44.648 21.537 21.796 1.00 0.00 H ATOM 570 HG12 VAL A 41 44.585 21.033 23.503 1.00 0.00 H ATOM 571 HG13 VAL A 41 45.405 22.548 23.052 1.00 0.00 H ATOM 572 HG21 VAL A 41 46.918 20.257 24.604 1.00 0.00 H ATOM 573 HG22 VAL A 41 48.348 20.429 23.556 1.00 0.00 H ATOM 574 HG23 VAL A 41 47.476 21.877 24.118 1.00 0.00 H ATOM 575 H VAL A 41 47.503 19.928 20.468 1.00 0.00 H ATOM 576 N GLU A 42 44.064 18.559 22.482 1.00 30.39 N ATOM 577 CA GLU A 42 42.666 18.283 22.174 1.00 32.35 C ATOM 578 C GLU A 42 41.882 19.318 22.980 1.00 29.42 C ATOM 579 O GLU A 42 42.202 19.365 24.174 1.00 29.10 O ATOM 580 CB GLU A 42 42.294 16.872 22.616 1.00 49.17 C ATOM 581 CG GLU A 42 42.790 15.772 21.688 1.00 68.68 C ATOM 582 CD GLU A 42 41.866 15.580 20.491 1.00 81.33 C ATOM 583 OE1 GLU A 42 42.012 16.275 19.453 1.00 85.02 O ATOM 584 OE2 GLU A 42 40.972 14.701 20.625 1.00 88.38 O ATOM 585 HA GLU A 42 42.456 18.344 21.106 1.00 0.00 H ATOM 586 HB2 GLU A 42 42.718 16.701 23.605 1.00 0.00 H ATOM 587 HB3 GLU A 42 41.207 16.807 22.672 1.00 0.00 H ATOM 588 HG2 GLU A 42 43.784 16.036 21.328 1.00 0.00 H ATOM 589 HG3 GLU A 42 42.844 14.837 22.246 1.00 0.00 H ATOM 590 H GLU A 42 44.390 18.402 23.457 1.00 0.00 H ATOM 591 N ALA A 43 40.952 20.078 22.442 1.00 26.34 N ATOM 592 CA ALA A 43 40.220 21.084 23.190 1.00 26.26 C ATOM 593 C ALA A 43 39.306 20.642 24.321 1.00 24.11 C ATOM 594 O ALA A 43 39.128 21.389 25.288 1.00 25.83 O ATOM 595 CB ALA A 43 39.347 21.922 22.238 1.00 21.27 C ATOM 596 HA ALA A 43 41.037 21.624 23.669 1.00 0.00 H ATOM 597 HB1 ALA A 43 39.983 22.415 21.503 1.00 0.00 H ATOM 598 HB2 ALA A 43 38.639 21.269 21.728 1.00 0.00 H ATOM 599 HB3 ALA A 43 38.803 22.673 22.812 1.00 0.00 H ATOM 600 H ALA A 43 40.731 19.952 21.434 1.00 0.00 H ATOM 601 N GLY A 44 38.702 19.474 24.242 1.00 24.91 N ATOM 602 CA GLY A 44 37.778 18.956 25.221 1.00 24.35 C ATOM 603 C GLY A 44 38.288 18.787 26.635 1.00 24.97 C ATOM 604 O GLY A 44 39.126 17.928 26.924 1.00 24.83 O ATOM 605 HA3 GLY A 44 37.446 17.978 24.873 1.00 0.00 H ATOM 606 HA2 GLY A 44 36.926 19.635 25.259 1.00 0.00 H ATOM 607 H GLY A 44 38.907 18.881 23.412 1.00 0.00 H ATOM 608 N GLY A 45 37.791 19.635 27.536 1.00 25.63 N ATOM 609 CA GLY A 45 38.207 19.623 28.934 1.00 23.98 C ATOM 610 C GLY A 45 39.666 20.018 29.126 1.00 24.46 C ATOM 611 O GLY A 45 40.232 19.853 30.224 1.00 22.97 O ATOM 612 HA3 GLY A 45 38.064 18.618 29.330 1.00 0.00 H ATOM 613 HA2 GLY A 45 37.582 20.323 29.488 1.00 0.00 H ATOM 614 H GLY A 45 37.081 20.331 27.231 1.00 0.00 H ATOM 615 N LEU A 46 40.353 20.568 28.127 1.00 20.81 N ATOM 616 CA LEU A 46 41.743 20.944 28.218 1.00 18.38 C ATOM 617 C LEU A 46 42.112 21.800 29.424 1.00 16.93 C ATOM 618 O LEU A 46 43.190 21.564 29.969 1.00 18.47 O ATOM 619 CB LEU A 46 42.147 21.712 26.947 1.00 16.59 C ATOM 620 CG LEU A 46 43.610 22.124 26.837 1.00 14.85 C ATOM 621 CD1 LEU A 46 44.580 20.963 26.836 1.00 17.06 C ATOM 622 CD2 LEU A 46 43.804 22.906 25.552 1.00 17.64 C ATOM 623 HA LEU A 46 42.282 20.004 28.333 1.00 0.00 H ATOM 624 HB2 LEU A 46 41.916 21.079 26.090 1.00 0.00 H ATOM 625 HB3 LEU A 46 41.543 22.618 26.902 1.00 0.00 H ATOM 626 HG LEU A 46 43.828 22.720 27.723 1.00 0.00 H ATOM 627 HD21 LEU A 46 43.532 22.280 24.702 1.00 0.00 H ATOM 628 HD22 LEU A 46 43.171 23.793 25.569 1.00 0.00 H ATOM 629 HD23 LEU A 46 44.848 23.205 25.464 1.00 0.00 H ATOM 630 HD11 LEU A 46 44.473 20.401 27.764 1.00 0.00 H ATOM 631 HD12 LEU A 46 44.365 20.312 25.989 1.00 0.00 H ATOM 632 HD13 LEU A 46 45.599 21.342 26.755 1.00 0.00 H ATOM 633 H LEU A 46 39.858 20.737 27.228 1.00 0.00 H ATOM 634 N PHE A 47 41.313 22.766 29.841 1.00 16.10 N ATOM 635 CA PHE A 47 41.682 23.614 30.959 1.00 19.04 C ATOM 636 C PHE A 47 41.307 23.049 32.322 1.00 22.79 C ATOM 637 O PHE A 47 41.697 23.680 33.302 1.00 22.20 O ATOM 638 CB PHE A 47 41.080 25.023 30.865 1.00 15.94 C ATOM 639 CG PHE A 47 41.369 25.746 29.591 1.00 15.96 C ATOM 640 CD1 PHE A 47 42.399 25.349 28.742 1.00 16.19 C ATOM 641 CD2 PHE A 47 40.623 26.857 29.245 1.00 18.23 C ATOM 642 CE1 PHE A 47 42.667 26.017 27.558 1.00 16.79 C ATOM 643 CE2 PHE A 47 40.895 27.549 28.073 1.00 16.63 C ATOM 644 CZ PHE A 47 41.910 27.123 27.226 1.00 13.76 C ATOM 645 HA PHE A 47 42.768 23.660 30.882 1.00 0.00 H ATOM 646 HB2 PHE A 47 39.998 24.937 30.968 1.00 0.00 H ATOM 647 HB3 PHE A 47 41.476 25.617 31.689 1.00 0.00 H ATOM 648 HD2 PHE A 47 39.816 27.192 29.897 1.00 0.00 H ATOM 649 HE2 PHE A 47 40.309 28.431 27.816 1.00 0.00 H ATOM 650 HZ PHE A 47 42.109 27.662 26.299 1.00 0.00 H ATOM 651 HE1 PHE A 47 43.464 25.674 26.898 1.00 0.00 H ATOM 652 HD1 PHE A 47 43.011 24.490 29.016 1.00 0.00 H ATOM 653 H PHE A 47 40.404 22.921 29.360 1.00 0.00 H ATOM 654 N GLU A 48 40.577 21.952 32.385 1.00 25.12 N ATOM 655 CA GLU A 48 40.184 21.373 33.667 1.00 28.64 C ATOM 656 C GLU A 48 41.400 20.954 34.488 1.00 27.66 C ATOM 657 O GLU A 48 42.315 20.275 34.010 1.00 28.43 O ATOM 658 CB GLU A 48 39.239 20.186 33.420 1.00 31.56 C ATOM 659 CG GLU A 48 37.868 20.667 32.938 1.00 44.46 C ATOM 660 CD GLU A 48 36.967 19.549 32.444 1.00 51.75 C ATOM 661 OE1 GLU A 48 37.155 18.407 32.925 1.00 56.00 O ATOM 662 OE2 GLU A 48 36.086 19.786 31.579 1.00 56.54 O ATOM 663 HA GLU A 48 39.659 22.130 34.249 1.00 0.00 H ATOM 664 HB2 GLU A 48 39.675 19.535 32.663 1.00 0.00 H ATOM 665 HB3 GLU A 48 39.115 19.629 34.349 1.00 0.00 H ATOM 666 HG2 GLU A 48 37.369 21.171 33.766 1.00 0.00 H ATOM 667 HG3 GLU A 48 38.018 21.374 32.122 1.00 0.00 H ATOM 668 H GLU A 48 40.275 21.490 31.504 1.00 0.00 H ATOM 669 N GLY A 49 41.425 21.391 35.747 1.00 28.31 N ATOM 670 CA GLY A 49 42.507 21.080 36.666 1.00 26.12 C ATOM 671 C GLY A 49 43.600 22.127 36.789 1.00 26.68 C ATOM 672 O GLY A 49 44.500 21.957 37.622 1.00 26.19 O ATOM 673 HA3 GLY A 49 42.971 20.151 36.333 1.00 0.00 H ATOM 674 HA2 GLY A 49 42.073 20.934 37.655 1.00 0.00 H ATOM 675 H GLY A 49 40.637 21.979 36.086 1.00 0.00 H ATOM 676 N PHE A 50 43.573 23.206 36.010 1.00 23.30 N ATOM 677 CA PHE A 50 44.605 24.232 36.070 1.00 20.82 C ATOM 678 C PHE A 50 44.119 25.476 36.771 1.00 16.02 C ATOM 679 O PHE A 50 42.977 25.902 36.599 1.00 17.90 O ATOM 680 CB PHE A 50 45.075 24.607 34.655 1.00 15.99 C ATOM 681 CG PHE A 50 45.839 23.470 34.052 1.00 17.30 C ATOM 682 CD1 PHE A 50 47.170 23.266 34.363 1.00 14.54 C ATOM 683 CD2 PHE A 50 45.221 22.585 33.188 1.00 16.00 C ATOM 684 CE1 PHE A 50 47.877 22.225 33.813 1.00 19.39 C ATOM 685 CE2 PHE A 50 45.915 21.526 32.641 1.00 15.67 C ATOM 686 CZ PHE A 50 47.250 21.341 32.951 1.00 20.64 C ATOM 687 HA PHE A 50 45.436 23.815 36.639 1.00 0.00 H ATOM 688 HB2 PHE A 50 44.208 24.830 34.033 1.00 0.00 H ATOM 689 HB3 PHE A 50 45.717 25.486 34.709 1.00 0.00 H ATOM 690 HD2 PHE A 50 44.170 22.726 32.935 1.00 0.00 H ATOM 691 HE2 PHE A 50 45.411 20.835 31.965 1.00 0.00 H ATOM 692 HZ PHE A 50 47.804 20.507 32.521 1.00 0.00 H ATOM 693 HE1 PHE A 50 48.932 22.095 34.055 1.00 0.00 H ATOM 694 HD1 PHE A 50 47.667 23.943 35.057 1.00 0.00 H ATOM 695 H PHE A 50 42.789 23.320 35.336 1.00 0.00 H ATOM 696 N ASP A 51 45.007 26.080 37.560 1.00 14.41 N ATOM 697 CA ASP A 51 44.679 27.290 38.285 1.00 15.00 C ATOM 698 C ASP A 51 44.823 28.520 37.402 1.00 14.57 C ATOM 699 O ASP A 51 44.224 29.553 37.635 1.00 15.21 O ATOM 700 CB ASP A 51 45.650 27.500 39.492 1.00 13.59 C ATOM 701 CG ASP A 51 45.518 26.310 40.427 1.00 15.15 C ATOM 702 OD1 ASP A 51 44.408 26.066 40.919 1.00 20.78 O ATOM 703 OD2 ASP A 51 46.481 25.561 40.640 1.00 18.50 O ATOM 704 HA ASP A 51 43.649 27.173 38.623 1.00 0.00 H ATOM 705 HB2 ASP A 51 46.676 27.573 39.131 1.00 0.00 H ATOM 706 HB3 ASP A 51 45.387 28.416 40.022 1.00 0.00 H ATOM 707 H ASP A 51 45.959 25.672 37.657 1.00 0.00 H ATOM 708 N LEU A 52 45.704 28.365 36.409 1.00 19.47 N ATOM 709 CA LEU A 52 46.027 29.425 35.460 1.00 17.05 C ATOM 710 C LEU A 52 46.291 28.824 34.065 1.00 16.82 C ATOM 711 O LEU A 52 46.976 27.805 33.946 1.00 14.70 O ATOM 712 CB LEU A 52 47.363 30.058 35.842 1.00 16.59 C ATOM 713 CG LEU A 52 47.754 31.494 35.657 1.00 20.12 C ATOM 714 CD1 LEU A 52 49.264 31.613 35.451 1.00 17.66 C ATOM 715 CD2 LEU A 52 46.993 32.295 34.642 1.00 15.94 C ATOM 716 HA LEU A 52 45.197 30.131 35.464 1.00 0.00 H ATOM 717 HB2 LEU A 52 47.471 29.870 36.910 1.00 0.00 H ATOM 718 HB3 LEU A 52 48.114 29.487 35.296 1.00 0.00 H ATOM 719 HG LEU A 52 47.455 31.965 36.593 1.00 0.00 H ATOM 720 HD21 LEU A 52 47.107 31.836 33.660 1.00 0.00 H ATOM 721 HD22 LEU A 52 45.938 32.316 34.915 1.00 0.00 H ATOM 722 HD23 LEU A 52 47.384 33.312 34.617 1.00 0.00 H ATOM 723 HD11 LEU A 52 49.781 31.213 36.323 1.00 0.00 H ATOM 724 HD12 LEU A 52 49.554 31.049 34.565 1.00 0.00 H ATOM 725 HD13 LEU A 52 49.530 32.662 35.318 1.00 0.00 H ATOM 726 H LEU A 52 46.181 27.446 36.308 1.00 0.00 H ATOM 727 N VAL A 53 45.735 29.487 33.056 1.00 14.67 N ATOM 728 CA VAL A 53 45.929 29.051 31.666 1.00 14.13 C ATOM 729 C VAL A 53 46.477 30.246 30.873 1.00 10.92 C ATOM 730 O VAL A 53 45.945 31.346 30.916 1.00 12.36 O ATOM 731 CB VAL A 53 44.633 28.490 31.064 1.00 14.29 C ATOM 732 CG1 VAL A 53 44.882 28.132 29.599 1.00 12.59 C ATOM 733 CG2 VAL A 53 44.175 27.233 31.805 1.00 13.76 C ATOM 734 HA VAL A 53 46.645 28.230 31.623 1.00 0.00 H ATOM 735 HB VAL A 53 43.856 29.249 31.154 1.00 0.00 H ATOM 736 HG11 VAL A 53 45.185 29.026 29.054 1.00 0.00 H ATOM 737 HG12 VAL A 53 45.672 27.383 29.538 1.00 0.00 H ATOM 738 HG13 VAL A 53 43.966 27.733 29.163 1.00 0.00 H ATOM 739 HG21 VAL A 53 44.950 26.469 31.735 1.00 0.00 H ATOM 740 HG22 VAL A 53 43.995 27.475 32.852 1.00 0.00 H ATOM 741 HG23 VAL A 53 43.255 26.862 31.354 1.00 0.00 H ATOM 742 H VAL A 53 45.154 30.327 33.253 1.00 0.00 H ATOM 743 N LEU A 54 47.588 30.118 30.174 1.00 11.10 N ATOM 744 CA LEU A 54 48.258 31.120 29.363 1.00 9.41 C ATOM 745 C LEU A 54 48.207 30.618 27.898 1.00 10.46 C ATOM 746 O LEU A 54 48.623 29.498 27.617 1.00 11.31 O ATOM 747 CB LEU A 54 49.710 31.309 29.813 1.00 9.38 C ATOM 748 CG LEU A 54 49.834 31.748 31.286 1.00 12.41 C ATOM 749 CD1 LEU A 54 51.275 31.902 31.703 1.00 13.77 C ATOM 750 CD2 LEU A 54 49.125 33.077 31.547 1.00 12.20 C ATOM 751 HA LEU A 54 47.765 32.087 29.465 1.00 0.00 H ATOM 752 HB2 LEU A 54 50.239 30.364 29.687 1.00 0.00 H ATOM 753 HB3 LEU A 54 50.172 32.070 29.184 1.00 0.00 H ATOM 754 HG LEU A 54 49.361 30.958 31.870 1.00 0.00 H ATOM 755 HD21 LEU A 54 49.567 33.852 30.921 1.00 0.00 H ATOM 756 HD22 LEU A 54 48.066 32.975 31.309 1.00 0.00 H ATOM 757 HD23 LEU A 54 49.238 33.348 32.597 1.00 0.00 H ATOM 758 HD11 LEU A 54 51.790 30.949 31.584 1.00 0.00 H ATOM 759 HD12 LEU A 54 51.754 32.656 31.078 1.00 0.00 H ATOM 760 HD13 LEU A 54 51.319 32.212 32.747 1.00 0.00 H ATOM 761 H LEU A 54 48.041 29.183 30.208 1.00 0.00 H ATOM 762 N LEU A 55 47.631 31.428 27.035 1.00 11.14 N ATOM 763 CA LEU A 55 47.459 31.053 25.617 1.00 12.71 C ATOM 764 C LEU A 55 48.270 31.971 24.727 1.00 8.48 C ATOM 765 O LEU A 55 48.082 33.175 24.843 1.00 10.75 O ATOM 766 CB LEU A 55 45.986 31.235 25.273 1.00 13.73 C ATOM 767 CG LEU A 55 45.039 30.061 25.269 1.00 22.94 C ATOM 768 CD1 LEU A 55 45.548 28.788 25.905 1.00 19.06 C ATOM 769 CD2 LEU A 55 43.695 30.500 25.833 1.00 21.20 C ATOM 770 HA LEU A 55 47.789 30.026 25.463 1.00 0.00 H ATOM 771 HB2 LEU A 55 45.587 31.953 25.989 1.00 0.00 H ATOM 772 HB3 LEU A 55 45.952 31.665 24.272 1.00 0.00 H ATOM 773 HG LEU A 55 44.932 29.766 24.225 1.00 0.00 H ATOM 774 HD21 LEU A 55 43.830 30.858 26.854 1.00 0.00 H ATOM 775 HD22 LEU A 55 43.288 31.301 25.216 1.00 0.00 H ATOM 776 HD23 LEU A 55 43.008 29.654 25.832 1.00 0.00 H ATOM 777 HD11 LEU A 55 46.443 28.454 25.380 1.00 0.00 H ATOM 778 HD12 LEU A 55 45.788 28.977 26.951 1.00 0.00 H ATOM 779 HD13 LEU A 55 44.779 28.018 25.841 1.00 0.00 H ATOM 780 H LEU A 55 47.289 32.355 27.360 1.00 0.00 H ATOM 781 N GLY A 56 49.109 31.357 23.903 1.00 10.05 N ATOM 782 CA GLY A 56 49.963 32.210 23.062 1.00 11.73 C ATOM 783 C GLY A 56 49.730 31.935 21.572 1.00 8.44 C ATOM 784 O GLY A 56 49.563 30.790 21.199 1.00 8.61 O ATOM 785 HA3 GLY A 56 51.008 32.012 23.301 1.00 0.00 H ATOM 786 HA2 GLY A 56 49.736 33.256 23.270 1.00 0.00 H ATOM 787 H GLY A 56 49.161 30.319 23.854 1.00 0.00 H ATOM 788 N CYS A 57 49.719 32.987 20.780 1.00 10.88 N ATOM 789 CA CYS A 57 49.470 32.775 19.335 1.00 9.16 C ATOM 790 C CYS A 57 49.960 33.924 18.486 1.00 5.83 C ATOM 791 O CYS A 57 49.712 35.092 18.789 1.00 8.95 O ATOM 792 CB CYS A 57 47.932 32.675 19.236 1.00 12.13 C ATOM 793 SG CYS A 57 47.295 32.215 17.623 1.00 11.63 S ATOM 794 HA CYS A 57 49.998 31.895 18.969 1.00 0.00 H ATOM 795 HB2 CYS A 57 47.514 33.647 19.499 1.00 0.00 H ATOM 796 HB3 CYS A 57 47.596 31.929 19.956 1.00 0.00 H ATOM 797 HG CYS A 57 47.688 33.153 16.690 1.00 0.00 H ATOM 798 H CYS A 57 49.881 33.942 21.159 1.00 0.00 H ATOM 799 N SER A 58 50.647 33.612 17.370 1.00 7.62 N ATOM 800 CA SER A 58 51.138 34.659 16.466 1.00 9.98 C ATOM 801 C SER A 58 50.021 35.088 15.508 1.00 8.81 C ATOM 802 O SER A 58 49.039 34.347 15.374 1.00 8.85 O ATOM 803 CB SER A 58 52.405 34.231 15.709 1.00 5.13 C ATOM 804 OG SER A 58 52.205 32.940 15.162 1.00 8.04 O ATOM 805 HA SER A 58 51.426 35.518 17.072 1.00 0.00 H ATOM 806 HB2 SER A 58 53.251 34.210 16.396 1.00 0.00 H ATOM 807 HB3 SER A 58 52.608 34.940 14.907 1.00 0.00 H ATOM 808 HG SER A 58 53.019 32.660 14.673 1.00 0.00 H ATOM 809 H SER A 58 50.832 32.614 17.145 1.00 0.00 H ATOM 810 N THR A 59 50.150 36.247 14.886 1.00 7.91 N ATOM 811 CA THR A 59 49.134 36.747 13.958 1.00 10.38 C ATOM 812 C THR A 59 49.693 36.731 12.520 1.00 10.61 C ATOM 813 O THR A 59 50.834 37.076 12.222 1.00 8.54 O ATOM 814 CB THR A 59 48.687 38.166 14.337 1.00 9.64 C ATOM 815 OG1 THR A 59 48.210 38.155 15.697 1.00 12.20 O ATOM 816 CG2 THR A 59 47.564 38.662 13.424 1.00 6.38 C ATOM 817 HA THR A 59 48.262 36.095 14.016 1.00 0.00 H ATOM 818 HB THR A 59 49.540 38.836 14.227 1.00 0.00 H ATOM 819 HG1 THR A 59 48.939 37.860 16.299 1.00 0.00 H ATOM 820 HG23 THR A 59 47.915 38.674 12.392 1.00 0.00 H ATOM 821 HG21 THR A 59 46.706 37.995 13.510 1.00 0.00 H ATOM 822 HG22 THR A 59 47.273 39.669 13.722 1.00 0.00 H ATOM 823 H THR A 59 50.999 36.821 15.061 1.00 0.00 H ATOM 824 N TRP A 60 48.888 36.195 11.613 1.00 11.72 N ATOM 825 CA TRP A 60 49.163 36.042 10.186 1.00 12.52 C ATOM 826 C TRP A 60 48.049 36.648 9.344 1.00 12.34 C ATOM 827 O TRP A 60 47.119 37.262 9.883 1.00 10.78 O ATOM 828 CB TRP A 60 49.222 34.507 9.900 1.00 8.02 C ATOM 829 CG TRP A 60 50.425 33.949 10.612 1.00 9.99 C ATOM 830 CD1 TRP A 60 50.453 33.437 11.888 1.00 13.17 C ATOM 831 CD2 TRP A 60 51.775 33.954 10.146 1.00 12.72 C ATOM 832 NE1 TRP A 60 51.734 33.131 12.231 1.00 11.37 N ATOM 833 CE2 TRP A 60 52.569 33.414 11.173 1.00 11.62 C ATOM 834 CE3 TRP A 60 52.376 34.350 8.936 1.00 9.51 C ATOM 835 CZ2 TRP A 60 53.943 33.231 11.038 1.00 10.69 C ATOM 836 CZ3 TRP A 60 53.741 34.144 8.811 1.00 9.04 C ATOM 837 CH2 TRP A 60 54.515 33.603 9.858 1.00 15.60 C ATOM 838 HA TRP A 60 50.094 36.548 9.932 1.00 0.00 H ATOM 839 HB2 TRP A 60 48.316 34.026 10.270 1.00 0.00 H ATOM 840 HB3 TRP A 60 49.312 34.333 8.828 1.00 0.00 H ATOM 841 HE1 TRP A 60 52.035 32.744 13.148 1.00 0.00 H ATOM 842 HD1 TRP A 60 49.582 33.297 12.528 1.00 0.00 H ATOM 843 HZ2 TRP A 60 54.539 32.806 11.846 1.00 0.00 H ATOM 844 HH2 TRP A 60 55.589 33.480 9.721 1.00 0.00 H ATOM 845 HZ3 TRP A 60 54.231 34.408 7.874 1.00 0.00 H ATOM 846 HE3 TRP A 60 51.793 34.799 8.132 1.00 0.00 H ATOM 847 H TRP A 60 47.968 35.848 11.951 1.00 0.00 H ATOM 848 N GLY A 61 48.085 36.496 8.021 1.00 13.24 N ATOM 849 CA GLY A 61 47.004 36.975 7.185 1.00 13.10 C ATOM 850 C GLY A 61 47.181 38.284 6.462 1.00 17.95 C ATOM 851 O GLY A 61 46.645 38.415 5.349 1.00 15.57 O ATOM 852 HA3 GLY A 61 46.125 37.075 7.821 1.00 0.00 H ATOM 853 HA2 GLY A 61 46.819 36.212 6.429 1.00 0.00 H ATOM 854 H GLY A 61 48.902 36.026 7.582 1.00 0.00 H ATOM 855 N ASP A 62 47.852 39.236 7.082 1.00 15.01 N ATOM 856 CA ASP A 62 48.086 40.542 6.504 1.00 17.44 C ATOM 857 C ASP A 62 46.846 41.405 6.327 1.00 20.74 C ATOM 858 O ASP A 62 46.537 42.268 7.168 1.00 22.41 O ATOM 859 CB ASP A 62 48.838 40.317 5.187 1.00 16.42 C ATOM 860 CG ASP A 62 49.339 41.634 4.629 1.00 24.62 C ATOM 861 OD1 ASP A 62 49.024 42.722 5.168 1.00 25.54 O ATOM 862 OD2 ASP A 62 50.075 41.606 3.623 1.00 26.18 O ATOM 863 HA ASP A 62 48.679 41.129 7.206 1.00 0.00 H ATOM 864 HB2 ASP A 62 49.687 39.657 5.367 1.00 0.00 H ATOM 865 HB3 ASP A 62 48.166 39.854 4.465 1.00 0.00 H ATOM 866 H ASP A 62 48.230 39.039 8.030 1.00 0.00 H ATOM 867 N ASP A 63 46.079 41.231 5.241 1.00 19.21 N ATOM 868 CA ASP A 63 44.893 42.030 4.967 1.00 20.96 C ATOM 869 C ASP A 63 43.685 41.664 5.812 1.00 21.57 C ATOM 870 O ASP A 63 42.779 42.461 6.037 1.00 18.96 O ATOM 871 CB ASP A 63 44.556 41.998 3.478 1.00 24.64 C ATOM 872 CG ASP A 63 44.331 40.623 2.916 1.00 33.05 C ATOM 873 OD1 ASP A 63 44.749 39.589 3.469 1.00 39.04 O ATOM 874 OD2 ASP A 63 43.682 40.545 1.850 1.00 46.94 O ATOM 875 HA ASP A 63 45.146 43.050 5.257 1.00 0.00 H ATOM 876 HB2 ASP A 63 43.649 42.582 3.322 1.00 0.00 H ATOM 877 HB3 ASP A 63 45.380 42.458 2.933 1.00 0.00 H ATOM 878 H ASP A 63 46.344 40.490 4.562 1.00 0.00 H ATOM 879 N SER A 64 43.611 40.436 6.283 1.00 21.04 N ATOM 880 CA SER A 64 42.587 39.908 7.153 1.00 22.39 C ATOM 881 C SER A 64 43.338 39.123 8.235 1.00 22.72 C ATOM 882 O SER A 64 44.382 38.562 7.907 1.00 28.26 O ATOM 883 CB SER A 64 41.688 38.915 6.436 1.00 23.66 C ATOM 884 OG SER A 64 40.889 39.510 5.444 1.00 30.17 O ATOM 885 HA SER A 64 41.968 40.723 7.529 1.00 0.00 H ATOM 886 HB2 SER A 64 41.035 38.444 7.171 1.00 0.00 H ATOM 887 HB3 SER A 64 42.314 38.155 5.968 1.00 0.00 H ATOM 888 HG SER A 64 40.328 38.817 5.014 1.00 0.00 H ATOM 889 H SER A 64 44.367 39.780 5.999 1.00 0.00 H ATOM 890 N ILE A 65 42.878 39.053 9.448 1.00 22.72 N ATOM 891 CA ILE A 65 43.616 38.287 10.464 1.00 20.69 C ATOM 892 C ILE A 65 43.421 36.800 10.211 1.00 16.41 C ATOM 893 O ILE A 65 42.320 36.324 9.907 1.00 15.94 O ATOM 894 CB ILE A 65 43.013 38.645 11.850 1.00 20.62 C ATOM 895 CG1 ILE A 65 43.467 40.060 12.243 1.00 23.25 C ATOM 896 CG2 ILE A 65 43.334 37.648 12.939 1.00 19.55 C ATOM 897 CD1 ILE A 65 42.616 40.620 13.386 1.00 21.42 C ATOM 898 HA ILE A 65 44.679 38.524 10.427 1.00 0.00 H ATOM 899 HB ILE A 65 41.928 38.608 11.748 1.00 0.00 H ATOM 900 HG12 ILE A 65 44.509 40.023 12.561 1.00 0.00 H ATOM 901 HG13 ILE A 65 43.375 40.716 11.377 1.00 0.00 H ATOM 902 HD11 ILE A 65 41.573 40.664 13.073 1.00 0.00 H ATOM 903 HD12 ILE A 65 42.708 39.971 14.257 1.00 0.00 H ATOM 904 HD13 ILE A 65 42.964 41.622 13.639 1.00 0.00 H ATOM 905 HG21 ILE A 65 42.942 36.670 12.661 1.00 0.00 H ATOM 906 HG22 ILE A 65 44.415 37.585 13.065 1.00 0.00 H ATOM 907 HG23 ILE A 65 42.876 37.972 13.873 1.00 0.00 H ATOM 908 H ILE A 65 41.992 39.536 9.699 1.00 0.00 H ATOM 909 N GLU A 66 44.468 36.024 10.370 1.00 13.29 N ATOM 910 CA GLU A 66 44.447 34.584 10.290 1.00 12.73 C ATOM 911 C GLU A 66 45.173 34.148 11.589 1.00 13.22 C ATOM 912 O GLU A 66 46.268 34.659 11.793 1.00 12.53 O ATOM 913 CB GLU A 66 45.182 33.922 9.157 1.00 22.37 C ATOM 914 CG GLU A 66 44.593 33.837 7.774 1.00 33.56 C ATOM 915 CD GLU A 66 43.206 33.223 7.808 1.00 44.34 C ATOM 916 OE1 GLU A 66 42.968 32.272 8.584 1.00 45.48 O ATOM 917 OE2 GLU A 66 42.353 33.741 7.047 1.00 55.39 O ATOM 918 HA GLU A 66 43.409 34.288 10.141 1.00 0.00 H ATOM 919 HB2 GLU A 66 46.129 34.451 9.055 1.00 0.00 H ATOM 920 HB3 GLU A 66 45.373 32.896 9.473 1.00 0.00 H ATOM 921 HG2 GLU A 66 44.528 34.840 7.352 1.00 0.00 H ATOM 922 HG3 GLU A 66 45.240 33.222 7.148 1.00 0.00 H ATOM 923 H GLU A 66 45.381 36.482 10.568 1.00 0.00 H ATOM 924 N LEU A 67 44.629 33.258 12.394 1.00 14.49 N ATOM 925 CA LEU A 67 45.351 32.829 13.594 1.00 16.05 C ATOM 926 C LEU A 67 46.448 31.853 13.152 1.00 15.23 C ATOM 927 O LEU A 67 46.335 31.257 12.088 1.00 13.80 O ATOM 928 CB LEU A 67 44.424 32.116 14.574 1.00 16.20 C ATOM 929 CG LEU A 67 43.799 32.924 15.711 1.00 20.97 C ATOM 930 CD1 LEU A 67 43.052 34.140 15.198 1.00 17.16 C ATOM 931 CD2 LEU A 67 42.890 31.969 16.474 1.00 19.65 C ATOM 932 HA LEU A 67 45.766 33.703 14.096 1.00 0.00 H ATOM 933 HB2 LEU A 67 43.605 31.693 13.992 1.00 0.00 H ATOM 934 HB3 LEU A 67 44.998 31.310 15.030 1.00 0.00 H ATOM 935 HG LEU A 67 44.570 33.325 16.369 1.00 0.00 H ATOM 936 HD21 LEU A 67 42.123 31.585 15.802 1.00 0.00 H ATOM 937 HD22 LEU A 67 43.481 31.141 16.864 1.00 0.00 H ATOM 938 HD23 LEU A 67 42.418 32.501 17.300 1.00 0.00 H ATOM 939 HD11 LEU A 67 43.742 34.788 14.658 1.00 0.00 H ATOM 940 HD12 LEU A 67 42.254 33.819 14.528 1.00 0.00 H ATOM 941 HD13 LEU A 67 42.624 34.684 16.040 1.00 0.00 H ATOM 942 H LEU A 67 43.692 32.862 12.178 1.00 0.00 H ATOM 943 N GLN A 68 47.493 31.669 13.942 1.00 12.22 N ATOM 944 CA GLN A 68 48.566 30.750 13.620 1.00 11.16 C ATOM 945 C GLN A 68 47.877 29.414 13.347 1.00 11.47 C ATOM 946 O GLN A 68 46.971 28.964 14.055 1.00 9.04 O ATOM 947 CB GLN A 68 49.632 30.715 14.720 1.00 8.44 C ATOM 948 CG GLN A 68 50.869 29.901 14.409 1.00 9.09 C ATOM 949 CD GLN A 68 50.748 28.404 14.535 1.00 11.01 C ATOM 950 OE1 GLN A 68 51.500 27.655 13.875 1.00 16.07 O ATOM 951 NE2 GLN A 68 49.852 27.914 15.383 1.00 7.01 N ATOM 952 HA GLN A 68 49.137 31.053 12.743 1.00 0.00 H ATOM 953 HB2 GLN A 68 49.946 31.740 14.915 1.00 0.00 H ATOM 954 HB3 GLN A 68 49.174 30.299 15.618 1.00 0.00 H ATOM 955 HG2 GLN A 68 51.161 30.123 13.382 1.00 0.00 H ATOM 956 HG3 GLN A 68 51.657 30.226 15.088 1.00 0.00 H ATOM 957 HE22 GLN A 68 49.238 28.559 15.921 1.00 0.00 H ATOM 958 HE21 GLN A 68 49.764 26.886 15.510 1.00 0.00 H ATOM 959 H GLN A 68 47.547 32.206 14.831 1.00 0.00 H ATOM 960 N ASP A 69 48.336 28.772 12.275 1.00 9.22 N ATOM 961 CA ASP A 69 47.766 27.526 11.800 1.00 13.32 C ATOM 962 C ASP A 69 47.437 26.439 12.802 1.00 13.71 C ATOM 963 O ASP A 69 46.322 25.874 12.756 1.00 12.23 O ATOM 964 CB ASP A 69 48.682 26.965 10.680 1.00 19.24 C ATOM 965 CG ASP A 69 47.947 25.848 9.961 1.00 23.63 C ATOM 966 OD1 ASP A 69 46.886 26.048 9.327 1.00 24.28 O ATOM 967 OD2 ASP A 69 48.435 24.708 10.089 1.00 26.13 O ATOM 968 HA ASP A 69 46.773 27.811 11.453 1.00 0.00 H ATOM 969 HB2 ASP A 69 48.925 27.758 9.973 1.00 0.00 H ATOM 970 HB3 ASP A 69 49.601 26.576 11.118 1.00 0.00 H ATOM 971 H ASP A 69 49.138 29.182 11.755 1.00 0.00 H ATOM 972 N ASP A 70 48.355 26.065 13.680 1.00 14.02 N ATOM 973 CA ASP A 70 48.097 25.038 14.684 1.00 15.57 C ATOM 974 C ASP A 70 47.072 25.482 15.721 1.00 13.32 C ATOM 975 O ASP A 70 46.380 24.634 16.285 1.00 15.83 O ATOM 976 CB ASP A 70 49.377 24.653 15.440 1.00 12.24 C ATOM 977 CG ASP A 70 50.439 24.171 14.485 1.00 14.51 C ATOM 978 OD1 ASP A 70 50.097 23.214 13.764 1.00 18.06 O ATOM 979 OD2 ASP A 70 51.578 24.669 14.411 1.00 14.31 O ATOM 980 HA ASP A 70 47.709 24.184 14.128 1.00 0.00 H ATOM 981 HB2 ASP A 70 49.750 25.524 15.979 1.00 0.00 H ATOM 982 HB3 ASP A 70 49.148 23.859 16.150 1.00 0.00 H ATOM 983 H ASP A 70 49.291 26.518 13.653 1.00 0.00 H ATOM 984 N PHE A 71 46.910 26.762 16.005 1.00 14.06 N ATOM 985 CA PHE A 71 45.985 27.267 17.002 1.00 11.72 C ATOM 986 C PHE A 71 44.559 27.356 16.526 1.00 17.53 C ATOM 987 O PHE A 71 43.628 27.375 17.344 1.00 14.13 O ATOM 988 CB PHE A 71 46.497 28.657 17.451 1.00 12.15 C ATOM 989 CG PHE A 71 46.097 28.982 18.869 1.00 14.95 C ATOM 990 CD1 PHE A 71 44.862 29.545 19.135 1.00 14.11 C ATOM 991 CD2 PHE A 71 46.953 28.706 19.914 1.00 17.57 C ATOM 992 CE1 PHE A 71 44.473 29.828 20.438 1.00 18.32 C ATOM 993 CE2 PHE A 71 46.581 28.983 21.228 1.00 18.36 C ATOM 994 CZ PHE A 71 45.345 29.553 21.483 1.00 14.99 C ATOM 995 HA PHE A 71 45.960 26.559 17.831 1.00 0.00 H ATOM 996 HB2 PHE A 71 47.585 28.670 17.381 1.00 0.00 H ATOM 997 HB3 PHE A 71 46.083 29.415 16.787 1.00 0.00 H ATOM 998 HD2 PHE A 71 47.930 28.267 19.710 1.00 0.00 H ATOM 999 HE2 PHE A 71 47.259 28.752 22.050 1.00 0.00 H ATOM 1000 HZ PHE A 71 45.056 29.787 22.508 1.00 0.00 H ATOM 1001 HE1 PHE A 71 43.493 30.262 20.638 1.00 0.00 H ATOM 1002 HD1 PHE A 71 44.185 29.770 18.311 1.00 0.00 H ATOM 1003 H PHE A 71 47.483 27.453 15.480 1.00 0.00 H ATOM 1004 N ILE A 72 44.305 27.369 15.208 1.00 16.37 N ATOM 1005 CA ILE A 72 42.933 27.455 14.706 1.00 16.19 C ATOM 1006 C ILE A 72 41.931 26.477 15.276 1.00 13.78 C ATOM 1007 O ILE A 72 40.877 26.905 15.775 1.00 14.74 O ATOM 1008 CB ILE A 72 42.914 27.508 13.161 1.00 15.33 C ATOM 1009 CG1 ILE A 72 43.547 28.833 12.732 1.00 10.88 C ATOM 1010 CG2 ILE A 72 41.484 27.421 12.642 1.00 16.08 C ATOM 1011 CD1 ILE A 72 43.859 28.822 11.233 1.00 16.61 C ATOM 1012 HA ILE A 72 42.563 28.402 15.100 1.00 0.00 H ATOM 1013 HB ILE A 72 43.471 26.666 12.750 1.00 0.00 H ATOM 1014 HG12 ILE A 72 42.855 29.647 12.948 1.00 0.00 H ATOM 1015 HG13 ILE A 72 44.471 28.986 13.289 1.00 0.00 H ATOM 1016 HD11 ILE A 72 44.554 28.011 11.014 1.00 0.00 H ATOM 1017 HD12 ILE A 72 42.936 28.673 10.672 1.00 0.00 H ATOM 1018 HD13 ILE A 72 44.308 29.774 10.950 1.00 0.00 H ATOM 1019 HG21 ILE A 72 41.036 26.483 12.970 1.00 0.00 H ATOM 1020 HG22 ILE A 72 40.905 28.258 13.033 1.00 0.00 H ATOM 1021 HG23 ILE A 72 41.491 27.460 11.553 1.00 0.00 H ATOM 1022 H ILE A 72 45.095 27.317 14.534 1.00 0.00 H ATOM 1023 N PRO A 73 42.175 25.177 15.244 1.00 16.12 N ATOM 1024 CA PRO A 73 41.295 24.144 15.771 1.00 18.64 C ATOM 1025 C PRO A 73 40.918 24.380 17.231 1.00 21.54 C ATOM 1026 O PRO A 73 39.751 24.228 17.631 1.00 23.21 O ATOM 1027 CB PRO A 73 41.995 22.810 15.521 1.00 17.63 C ATOM 1028 CG PRO A 73 43.042 23.172 14.519 1.00 18.71 C ATOM 1029 CD PRO A 73 43.392 24.622 14.656 1.00 16.39 C ATOM 1030 HA PRO A 73 40.331 24.155 15.262 1.00 0.00 H ATOM 1031 HD3 PRO A 73 44.249 24.762 15.315 1.00 0.00 H ATOM 1032 HD2 PRO A 73 43.604 25.072 13.686 1.00 0.00 H ATOM 1033 HG3 PRO A 73 42.663 22.984 13.514 1.00 0.00 H ATOM 1034 HG2 PRO A 73 43.932 22.566 14.690 1.00 0.00 H ATOM 1035 HB2 PRO A 73 42.443 22.423 16.436 1.00 0.00 H ATOM 1036 HB3 PRO A 73 41.302 22.072 15.117 1.00 0.00 H ATOM 1037 N LEU A 74 41.861 24.785 18.087 1.00 20.86 N ATOM 1038 CA LEU A 74 41.614 25.070 19.502 1.00 17.95 C ATOM 1039 C LEU A 74 40.720 26.273 19.694 1.00 15.83 C ATOM 1040 O LEU A 74 39.744 26.313 20.442 1.00 16.87 O ATOM 1041 CB LEU A 74 42.968 25.226 20.216 1.00 16.81 C ATOM 1042 CG LEU A 74 42.898 25.629 21.687 1.00 18.64 C ATOM 1043 CD1 LEU A 74 42.070 24.688 22.538 1.00 18.34 C ATOM 1044 CD2 LEU A 74 44.317 25.731 22.216 1.00 19.97 C ATOM 1045 HA LEU A 74 41.072 24.236 19.947 1.00 0.00 H ATOM 1046 HB2 LEU A 74 43.491 24.272 20.154 1.00 0.00 H ATOM 1047 HB3 LEU A 74 43.540 25.988 19.687 1.00 0.00 H ATOM 1048 HG LEU A 74 42.388 26.590 21.750 1.00 0.00 H ATOM 1049 HD21 LEU A 74 44.812 24.765 22.114 1.00 0.00 H ATOM 1050 HD22 LEU A 74 44.863 26.483 21.646 1.00 0.00 H ATOM 1051 HD23 LEU A 74 44.292 26.018 23.267 1.00 0.00 H ATOM 1052 HD11 LEU A 74 41.048 24.662 22.159 1.00 0.00 H ATOM 1053 HD12 LEU A 74 42.501 23.688 22.495 1.00 0.00 H ATOM 1054 HD13 LEU A 74 42.068 25.040 23.570 1.00 0.00 H ATOM 1055 H LEU A 74 42.829 24.905 17.726 1.00 0.00 H ATOM 1056 N PHE A 75 41.010 27.349 18.951 1.00 16.10 N ATOM 1057 CA PHE A 75 40.233 28.579 18.996 1.00 15.98 C ATOM 1058 C PHE A 75 38.779 28.277 18.649 1.00 18.32 C ATOM 1059 O PHE A 75 37.838 28.715 19.299 1.00 18.04 O ATOM 1060 CB PHE A 75 40.817 29.612 18.041 1.00 16.34 C ATOM 1061 CG PHE A 75 40.047 30.906 17.973 1.00 18.76 C ATOM 1062 CD1 PHE A 75 40.212 31.880 18.939 1.00 17.83 C ATOM 1063 CD2 PHE A 75 39.167 31.156 16.931 1.00 21.38 C ATOM 1064 CE1 PHE A 75 39.544 33.085 18.881 1.00 17.63 C ATOM 1065 CE2 PHE A 75 38.471 32.351 16.865 1.00 24.02 C ATOM 1066 CZ PHE A 75 38.664 33.321 17.842 1.00 25.08 C ATOM 1067 HA PHE A 75 40.274 28.994 20.003 1.00 0.00 H ATOM 1068 HB2 PHE A 75 41.834 29.837 18.363 1.00 0.00 H ATOM 1069 HB3 PHE A 75 40.841 29.177 17.042 1.00 0.00 H ATOM 1070 HD2 PHE A 75 39.022 30.404 16.156 1.00 0.00 H ATOM 1071 HE2 PHE A 75 37.772 32.531 16.048 1.00 0.00 H ATOM 1072 HZ PHE A 75 38.122 34.265 17.789 1.00 0.00 H ATOM 1073 HE1 PHE A 75 39.708 33.843 19.647 1.00 0.00 H ATOM 1074 HD1 PHE A 75 40.890 31.690 19.771 1.00 0.00 H ATOM 1075 H PHE A 75 41.829 27.304 18.312 1.00 0.00 H ATOM 1076 N ASP A 76 38.561 27.498 17.603 1.00 18.08 N ATOM 1077 CA ASP A 76 37.251 27.095 17.130 1.00 22.49 C ATOM 1078 C ASP A 76 36.491 26.247 18.139 1.00 22.19 C ATOM 1079 O ASP A 76 35.258 26.260 18.104 1.00 27.50 O ATOM 1080 CB ASP A 76 37.352 26.307 15.813 1.00 23.38 C ATOM 1081 CG ASP A 76 37.647 27.215 14.635 1.00 31.04 C ATOM 1082 OD1 ASP A 76 37.413 28.448 14.662 1.00 33.73 O ATOM 1083 OD2 ASP A 76 38.148 26.646 13.632 1.00 40.17 O ATOM 1084 HA ASP A 76 36.701 28.023 16.974 1.00 0.00 H ATOM 1085 HB2 ASP A 76 38.152 25.572 15.902 1.00 0.00 H ATOM 1086 HB3 ASP A 76 36.407 25.794 15.635 1.00 0.00 H ATOM 1087 H ASP A 76 39.390 27.149 17.081 1.00 0.00 H ATOM 1088 N SER A 77 37.166 25.519 19.007 1.00 20.45 N ATOM 1089 CA SER A 77 36.497 24.702 20.004 1.00 22.09 C ATOM 1090 C SER A 77 36.746 25.252 21.397 1.00 20.69 C ATOM 1091 O SER A 77 36.641 24.459 22.335 1.00 23.16 O ATOM 1092 CB SER A 77 37.073 23.279 19.986 1.00 25.77 C ATOM 1093 OG SER A 77 36.899 22.691 18.724 1.00 40.79 O ATOM 1094 HA SER A 77 35.432 24.704 19.770 1.00 0.00 H ATOM 1095 HB2 SER A 77 36.561 22.676 20.736 1.00 0.00 H ATOM 1096 HB3 SER A 77 38.137 23.320 20.219 1.00 0.00 H ATOM 1097 HG SER A 77 37.276 21.776 18.733 1.00 0.00 H ATOM 1098 H SER A 77 38.205 25.530 18.977 1.00 0.00 H ATOM 1099 N LEU A 78 37.070 26.529 21.560 1.00 18.94 N ATOM 1100 CA LEU A 78 37.339 27.068 22.884 1.00 19.59 C ATOM 1101 C LEU A 78 36.205 26.865 23.880 1.00 21.96 C ATOM 1102 O LEU A 78 36.407 26.814 25.092 1.00 18.02 O ATOM 1103 CB LEU A 78 37.716 28.544 22.847 1.00 17.53 C ATOM 1104 CG LEU A 78 39.188 28.933 22.771 1.00 22.33 C ATOM 1105 CD1 LEU A 78 39.292 30.445 22.907 1.00 19.77 C ATOM 1106 CD2 LEU A 78 40.051 28.241 23.806 1.00 17.15 C ATOM 1107 HA LEU A 78 38.192 26.487 23.235 1.00 0.00 H ATOM 1108 HB2 LEU A 78 37.226 28.976 21.974 1.00 0.00 H ATOM 1109 HB3 LEU A 78 37.312 28.999 23.751 1.00 0.00 H ATOM 1110 HG LEU A 78 39.572 28.603 21.806 1.00 0.00 H ATOM 1111 HD21 LEU A 78 39.696 28.499 24.804 1.00 0.00 H ATOM 1112 HD22 LEU A 78 39.991 27.162 23.665 1.00 0.00 H ATOM 1113 HD23 LEU A 78 41.085 28.566 23.691 1.00 0.00 H ATOM 1114 HD11 LEU A 78 38.738 30.920 22.098 1.00 0.00 H ATOM 1115 HD12 LEU A 78 38.873 30.752 23.865 1.00 0.00 H ATOM 1116 HD13 LEU A 78 40.339 30.742 22.855 1.00 0.00 H ATOM 1117 H LEU A 78 37.132 27.152 20.730 1.00 0.00 H ATOM 1118 N GLU A 79 34.975 26.732 23.413 1.00 23.86 N ATOM 1119 CA GLU A 79 33.770 26.489 24.165 1.00 25.84 C ATOM 1120 C GLU A 79 33.854 25.168 24.937 1.00 23.70 C ATOM 1121 O GLU A 79 33.140 25.037 25.933 1.00 25.00 O ATOM 1122 CB GLU A 79 32.526 26.322 23.255 1.00 29.08 C ATOM 1123 CG GLU A 79 32.169 27.525 22.430 1.00 41.28 C ATOM 1124 CD GLU A 79 33.011 27.777 21.195 1.00 44.25 C ATOM 1125 OE1 GLU A 79 33.894 26.971 20.850 1.00 40.01 O ATOM 1126 OE2 GLU A 79 32.765 28.818 20.533 1.00 53.33 O ATOM 1127 HA GLU A 79 33.674 27.355 24.819 1.00 0.00 H ATOM 1128 HB2 GLU A 79 32.715 25.491 22.575 1.00 0.00 H ATOM 1129 HB3 GLU A 79 31.673 26.084 23.890 1.00 0.00 H ATOM 1130 HG2 GLU A 79 31.134 27.409 22.107 1.00 0.00 H ATOM 1131 HG3 GLU A 79 32.252 28.402 23.071 1.00 0.00 H ATOM 1132 H GLU A 79 34.864 26.812 22.382 1.00 0.00 H ATOM 1133 N GLU A 80 34.638 24.200 24.497 1.00 21.25 N ATOM 1134 CA GLU A 80 34.781 22.923 25.137 1.00 23.06 C ATOM 1135 C GLU A 80 35.946 22.733 26.103 1.00 21.82 C ATOM 1136 O GLU A 80 36.058 21.636 26.675 1.00 22.62 O ATOM 1137 CB GLU A 80 35.096 21.921 23.993 1.00 27.24 C ATOM 1138 CG GLU A 80 34.100 21.944 22.858 1.00 45.58 C ATOM 1139 CD GLU A 80 34.418 20.914 21.787 1.00 55.02 C ATOM 1140 OE1 GLU A 80 35.321 20.070 21.986 1.00 56.09 O ATOM 1141 OE2 GLU A 80 33.733 20.975 20.735 1.00 64.19 O ATOM 1142 HA GLU A 80 33.866 22.797 25.716 1.00 0.00 H ATOM 1143 HB2 GLU A 80 36.080 22.161 23.590 1.00 0.00 H ATOM 1144 HB3 GLU A 80 35.112 20.916 24.414 1.00 0.00 H ATOM 1145 HG2 GLU A 80 33.108 21.738 23.259 1.00 0.00 H ATOM 1146 HG3 GLU A 80 34.109 22.935 22.404 1.00 0.00 H ATOM 1147 H GLU A 80 35.187 24.374 23.631 1.00 0.00 H ATOM 1148 N THR A 81 36.838 23.695 26.260 1.00 21.74 N ATOM 1149 CA THR A 81 38.015 23.574 27.102 1.00 18.53 C ATOM 1150 C THR A 81 37.797 23.750 28.592 1.00 20.35 C ATOM 1151 O THR A 81 38.692 23.370 29.339 1.00 21.01 O ATOM 1152 CB THR A 81 39.061 24.652 26.706 1.00 16.48 C ATOM 1153 OG1 THR A 81 38.454 25.938 26.917 1.00 14.69 O ATOM 1154 CG2 THR A 81 39.471 24.484 25.258 1.00 13.99 C ATOM 1155 HA THR A 81 38.338 22.547 26.932 1.00 0.00 H ATOM 1156 HB THR A 81 39.962 24.554 27.312 1.00 0.00 H ATOM 1157 HG1 THR A 81 37.644 26.016 26.353 1.00 0.00 H ATOM 1158 HG23 THR A 81 39.928 23.504 25.122 1.00 0.00 H ATOM 1159 HG21 THR A 81 38.591 24.567 24.620 1.00 0.00 H ATOM 1160 HG22 THR A 81 40.188 25.260 24.992 1.00 0.00 H ATOM 1161 H THR A 81 36.689 24.590 25.752 1.00 0.00 H ATOM 1162 N GLY A 82 36.686 24.336 29.010 1.00 21.51 N ATOM 1163 CA GLY A 82 36.442 24.564 30.432 1.00 23.73 C ATOM 1164 C GLY A 82 36.928 25.944 30.865 1.00 22.47 C ATOM 1165 O GLY A 82 37.436 26.136 31.971 1.00 22.83 O ATOM 1166 HA3 GLY A 82 36.970 23.805 31.009 1.00 0.00 H ATOM 1167 HA2 GLY A 82 35.372 24.487 30.625 1.00 0.00 H ATOM 1168 H GLY A 82 35.975 24.639 28.314 1.00 0.00 H ATOM 1169 N ALA A 83 36.760 26.948 30.022 1.00 19.88 N ATOM 1170 CA ALA A 83 37.173 28.305 30.262 1.00 16.69 C ATOM 1171 C ALA A 83 36.300 29.110 31.189 1.00 19.06 C ATOM 1172 O ALA A 83 36.692 30.168 31.722 1.00 19.06 O ATOM 1173 CB ALA A 83 37.267 29.008 28.892 1.00 24.29 C ATOM 1174 HA ALA A 83 38.129 28.250 30.783 1.00 0.00 H ATOM 1175 HB1 ALA A 83 37.997 28.491 28.269 1.00 0.00 H ATOM 1176 HB2 ALA A 83 36.292 28.986 28.406 1.00 0.00 H ATOM 1177 HB3 ALA A 83 37.579 30.042 29.036 1.00 0.00 H ATOM 1178 H ALA A 83 36.294 26.741 29.116 1.00 0.00 H ATOM 1179 N GLN A 84 35.073 28.683 31.428 1.00 21.39 N ATOM 1180 CA GLN A 84 34.177 29.451 32.311 1.00 24.92 C ATOM 1181 C GLN A 84 34.762 29.557 33.711 1.00 23.23 C ATOM 1182 O GLN A 84 35.100 28.543 34.333 1.00 25.20 O ATOM 1183 CB GLN A 84 32.812 28.789 32.210 1.00 36.77 C ATOM 1184 CG GLN A 84 31.889 28.909 33.390 1.00 56.18 C ATOM 1185 CD GLN A 84 30.700 29.820 33.181 1.00 62.83 C ATOM 1186 OE1 GLN A 84 30.828 31.037 33.322 1.00 69.72 O ATOM 1187 NE2 GLN A 84 29.577 29.181 32.857 1.00 66.72 N ATOM 1188 HA GLN A 84 34.066 30.493 32.011 1.00 0.00 H ATOM 1189 HB2 GLN A 84 32.301 29.224 31.351 1.00 0.00 H ATOM 1190 HB3 GLN A 84 32.977 27.726 32.032 1.00 0.00 H ATOM 1191 HG2 GLN A 84 31.515 27.914 33.630 1.00 0.00 H ATOM 1192 HG3 GLN A 84 32.465 29.292 34.233 1.00 0.00 H ATOM 1193 HE22 GLN A 84 29.577 28.145 32.763 1.00 0.00 H ATOM 1194 HE21 GLN A 84 28.701 29.718 32.698 1.00 0.00 H ATOM 1195 H GLN A 84 34.738 27.801 30.991 1.00 0.00 H ATOM 1196 N GLY A 85 34.937 30.770 34.224 1.00 20.70 N ATOM 1197 CA GLY A 85 35.499 31.045 35.533 1.00 21.98 C ATOM 1198 C GLY A 85 36.977 30.759 35.741 1.00 23.28 C ATOM 1199 O GLY A 85 37.515 30.848 36.849 1.00 24.13 O ATOM 1200 HA3 GLY A 85 34.946 30.447 36.257 1.00 0.00 H ATOM 1201 HA2 GLY A 85 35.339 32.103 35.740 1.00 0.00 H ATOM 1202 H GLY A 85 34.649 31.584 33.644 1.00 0.00 H ATOM 1203 N ARG A 86 37.701 30.415 34.684 1.00 20.68 N ATOM 1204 CA ARG A 86 39.099 30.101 34.628 1.00 15.88 C ATOM 1205 C ARG A 86 39.926 31.379 34.537 1.00 16.05 C ATOM 1206 O ARG A 86 39.547 32.329 33.844 1.00 17.47 O ATOM 1207 CB ARG A 86 39.350 29.241 33.391 1.00 18.73 C ATOM 1208 CG ARG A 86 40.718 28.624 33.203 1.00 21.82 C ATOM 1209 CD ARG A 86 40.887 27.407 34.097 1.00 18.59 C ATOM 1210 NE ARG A 86 39.755 26.522 33.949 1.00 18.51 N ATOM 1211 CZ ARG A 86 39.445 25.455 34.664 1.00 25.77 C ATOM 1212 NH1 ARG A 86 40.180 25.062 35.690 1.00 22.13 N ATOM 1213 NH2 ARG A 86 38.365 24.729 34.404 1.00 27.94 N ATOM 1214 HA ARG A 86 39.391 29.564 35.531 1.00 0.00 H ATOM 1215 HB2 ARG A 86 38.629 28.424 33.416 1.00 0.00 H ATOM 1216 HB3 ARG A 86 39.157 29.867 32.520 1.00 0.00 H ATOM 1217 HG2 ARG A 86 40.835 28.322 32.162 1.00 0.00 H ATOM 1218 HG3 ARG A 86 41.481 29.361 33.454 1.00 0.00 H ATOM 1219 HD2 ARG A 86 40.960 27.729 35.136 1.00 0.00 H ATOM 1220 HD3 ARG A 86 41.798 26.878 33.818 1.00 0.00 H ATOM 1221 HE ARG A 86 39.097 26.755 33.178 1.00 0.00 H ATOM 1222 HH12 ARG A 86 39.907 24.217 36.232 1.00 0.00 H ATOM 1223 HH11 ARG A 86 41.031 25.598 35.956 1.00 0.00 H ATOM 1224 HH22 ARG A 86 38.147 23.894 34.985 1.00 0.00 H ATOM 1225 HH21 ARG A 86 37.736 24.995 33.619 1.00 0.00 H ATOM 1226 H ARG A 86 37.189 30.367 33.780 1.00 0.00 H ATOM 1227 N LYS A 87 41.047 31.406 35.267 1.00 12.94 N ATOM 1228 CA LYS A 87 41.940 32.564 35.249 1.00 15.99 C ATOM 1229 C LYS A 87 42.844 32.347 34.022 1.00 13.29 C ATOM 1230 O LYS A 87 43.479 31.297 33.894 1.00 15.07 O ATOM 1231 CB LYS A 87 42.760 32.709 36.527 1.00 21.66 C ATOM 1232 CG LYS A 87 41.860 33.169 37.678 1.00 24.69 C ATOM 1233 CD LYS A 87 42.512 33.024 39.041 1.00 33.16 C ATOM 1234 CE LYS A 87 41.545 33.550 40.104 1.00 39.21 C ATOM 1235 NZ LYS A 87 42.266 34.055 41.310 1.00 52.22 N ATOM 1236 HA LYS A 87 41.371 33.492 35.190 1.00 0.00 H ATOM 1237 HB2 LYS A 87 43.207 31.748 36.780 1.00 0.00 H ATOM 1238 HB3 LYS A 87 43.548 33.445 36.369 1.00 0.00 H ATOM 1239 HG2 LYS A 87 41.609 34.218 37.524 1.00 0.00 H ATOM 1240 HG3 LYS A 87 40.948 32.572 37.665 1.00 0.00 H ATOM 1241 HD2 LYS A 87 42.733 31.974 39.233 1.00 0.00 H ATOM 1242 HD3 LYS A 87 43.437 33.600 39.069 1.00 0.00 H ATOM 1243 HE2 LYS A 87 40.877 32.742 40.404 1.00 0.00 H ATOM 1244 HE3 LYS A 87 40.959 34.364 39.676 1.00 0.00 H ATOM 1245 HZ1 LYS A 87 42.823 33.283 41.728 1.00 0.00 H ATOM 1246 HZ2 LYS A 87 42.901 34.831 41.033 1.00 0.00 H ATOM 1247 HZ3 LYS A 87 41.575 34.402 42.005 1.00 0.00 H ATOM 1248 H LYS A 87 41.288 30.586 35.860 1.00 0.00 H ATOM 1249 N VAL A 88 42.792 33.306 33.105 1.00 15.21 N ATOM 1250 CA VAL A 88 43.575 33.165 31.881 1.00 15.41 C ATOM 1251 C VAL A 88 44.251 34.486 31.527 1.00 13.26 C ATOM 1252 O VAL A 88 43.876 35.570 31.977 1.00 13.80 O ATOM 1253 CB VAL A 88 42.692 32.738 30.678 1.00 14.30 C ATOM 1254 CG1 VAL A 88 41.956 31.428 30.842 1.00 12.79 C ATOM 1255 CG2 VAL A 88 41.644 33.816 30.403 1.00 22.08 C ATOM 1256 HA VAL A 88 44.320 32.392 32.071 1.00 0.00 H ATOM 1257 HB VAL A 88 43.397 32.605 29.857 1.00 0.00 H ATOM 1258 HG11 VAL A 88 42.677 30.625 30.995 1.00 0.00 H ATOM 1259 HG12 VAL A 88 41.292 31.491 31.704 1.00 0.00 H ATOM 1260 HG13 VAL A 88 41.371 31.227 29.945 1.00 0.00 H ATOM 1261 HG21 VAL A 88 41.017 33.945 31.285 1.00 0.00 H ATOM 1262 HG22 VAL A 88 42.144 34.756 30.170 1.00 0.00 H ATOM 1263 HG23 VAL A 88 41.026 33.513 29.558 1.00 0.00 H ATOM 1264 H VAL A 88 42.200 34.148 33.257 1.00 0.00 H ATOM 1265 N ALA A 89 45.279 34.384 30.664 1.00 13.77 N ATOM 1266 CA ALA A 89 46.011 35.545 30.159 1.00 12.94 C ATOM 1267 C ALA A 89 46.575 35.114 28.779 1.00 10.31 C ATOM 1268 O ALA A 89 46.824 33.944 28.548 1.00 11.95 O ATOM 1269 CB ALA A 89 47.038 36.165 31.051 1.00 13.86 C ATOM 1270 HA ALA A 89 45.313 36.379 30.092 1.00 0.00 H ATOM 1271 HB1 ALA A 89 46.561 36.506 31.970 1.00 0.00 H ATOM 1272 HB2 ALA A 89 47.803 35.427 31.290 1.00 0.00 H ATOM 1273 HB3 ALA A 89 47.496 37.013 30.541 1.00 0.00 H ATOM 1274 H ALA A 89 45.565 33.437 30.342 1.00 0.00 H ATOM 1275 N CYS A 90 46.695 36.095 27.896 1.00 11.14 N ATOM 1276 CA CYS A 90 47.132 35.790 26.531 1.00 11.92 C ATOM 1277 C CYS A 90 48.383 36.506 26.123 1.00 8.30 C ATOM 1278 O CYS A 90 48.647 37.587 26.621 1.00 11.76 O ATOM 1279 CB CYS A 90 46.011 36.285 25.576 1.00 11.53 C ATOM 1280 SG CYS A 90 44.477 35.366 25.814 1.00 17.67 S ATOM 1281 HA CYS A 90 47.329 34.719 26.484 1.00 0.00 H ATOM 1282 HB2 CYS A 90 46.343 36.158 24.546 1.00 0.00 H ATOM 1283 HB3 CYS A 90 45.824 37.341 25.768 1.00 0.00 H ATOM 1284 HG CYS A 90 43.517 35.843 24.945 1.00 0.00 H ATOM 1285 H CYS A 90 46.480 37.075 28.170 1.00 0.00 H ATOM 1286 N PHE A 91 49.110 35.899 25.186 1.00 9.09 N ATOM 1287 CA PHE A 91 50.348 36.521 24.717 1.00 10.09 C ATOM 1288 C PHE A 91 50.520 36.192 23.220 1.00 10.10 C ATOM 1289 O PHE A 91 49.860 35.263 22.767 1.00 9.90 O ATOM 1290 CB PHE A 91 51.587 36.021 25.486 1.00 8.55 C ATOM 1291 CG PHE A 91 51.896 34.549 25.519 1.00 11.39 C ATOM 1292 CD1 PHE A 91 51.249 33.692 26.395 1.00 8.37 C ATOM 1293 CD2 PHE A 91 52.842 33.991 24.669 1.00 11.08 C ATOM 1294 CE1 PHE A 91 51.516 32.343 26.415 1.00 12.26 C ATOM 1295 CE2 PHE A 91 53.125 32.635 24.695 1.00 9.10 C ATOM 1296 CZ PHE A 91 52.457 31.786 25.559 1.00 11.54 C ATOM 1297 HA PHE A 91 50.271 37.595 24.886 1.00 0.00 H ATOM 1298 HB2 PHE A 91 52.453 36.517 25.048 1.00 0.00 H ATOM 1299 HB3 PHE A 91 51.469 36.344 26.521 1.00 0.00 H ATOM 1300 HD2 PHE A 91 53.373 34.633 23.967 1.00 0.00 H ATOM 1301 HE2 PHE A 91 53.885 32.232 24.025 1.00 0.00 H ATOM 1302 HZ PHE A 91 52.662 30.716 25.568 1.00 0.00 H ATOM 1303 HE1 PHE A 91 50.980 31.701 27.114 1.00 0.00 H ATOM 1304 HD1 PHE A 91 50.510 34.097 27.086 1.00 0.00 H ATOM 1305 H PHE A 91 48.799 34.989 24.791 1.00 0.00 H ATOM 1306 N GLY A 92 51.387 36.893 22.517 1.00 10.99 N ATOM 1307 CA GLY A 92 51.590 36.541 21.110 1.00 12.06 C ATOM 1308 C GLY A 92 52.588 37.471 20.432 1.00 10.69 C ATOM 1309 O GLY A 92 52.871 38.566 20.893 1.00 12.51 O ATOM 1310 HA3 GLY A 92 50.635 36.607 20.588 1.00 0.00 H ATOM 1311 HA2 GLY A 92 51.964 35.519 21.052 1.00 0.00 H ATOM 1312 H GLY A 92 51.914 37.677 22.951 1.00 0.00 H ATOM 1313 N CYS A 93 53.130 36.992 19.322 1.00 10.82 N ATOM 1314 CA CYS A 93 54.093 37.751 18.523 1.00 11.61 C ATOM 1315 C CYS A 93 53.419 38.254 17.239 1.00 9.78 C ATOM 1316 O CYS A 93 52.513 37.623 16.707 1.00 10.94 O ATOM 1317 CB CYS A 93 55.299 36.861 18.210 1.00 11.04 C ATOM 1318 SG CYS A 93 56.287 36.497 19.716 1.00 13.55 S ATOM 1319 HA CYS A 93 54.441 38.620 19.080 1.00 0.00 H ATOM 1320 HB2 CYS A 93 55.935 37.369 17.485 1.00 0.00 H ATOM 1321 HB3 CYS A 93 54.944 35.922 17.785 1.00 0.00 H ATOM 1322 HG CYS A 93 57.358 35.694 19.379 1.00 0.00 H ATOM 1323 H CYS A 93 52.860 36.039 19.006 1.00 0.00 H ATOM 1324 N GLY A 94 53.857 39.402 16.778 1.00 9.80 N ATOM 1325 CA GLY A 94 53.327 40.027 15.584 1.00 11.87 C ATOM 1326 C GLY A 94 54.316 41.089 15.107 1.00 11.96 C ATOM 1327 O GLY A 94 55.508 41.089 15.422 1.00 12.31 O ATOM 1328 HA3 GLY A 94 52.368 40.493 15.809 1.00 0.00 H ATOM 1329 HA2 GLY A 94 53.191 39.276 14.806 1.00 0.00 H ATOM 1330 H GLY A 94 54.620 39.885 17.294 1.00 0.00 H ATOM 1331 N ALA A 95 53.831 42.021 14.310 1.00 12.82 N ATOM 1332 CA ALA A 95 54.697 43.074 13.782 1.00 14.50 C ATOM 1333 C ALA A 95 53.802 44.283 13.586 1.00 15.16 C ATOM 1334 O ALA A 95 52.757 44.187 12.937 1.00 15.92 O ATOM 1335 CB ALA A 95 55.342 42.623 12.482 1.00 14.98 C ATOM 1336 HA ALA A 95 55.518 43.312 14.458 1.00 0.00 H ATOM 1337 HB1 ALA A 95 55.938 41.729 12.665 1.00 0.00 H ATOM 1338 HB2 ALA A 95 54.565 42.400 11.751 1.00 0.00 H ATOM 1339 HB3 ALA A 95 55.984 43.418 12.101 1.00 0.00 H ATOM 1340 H ALA A 95 52.823 42.007 14.055 1.00 0.00 H ATOM 1341 N SER A 96 54.211 45.397 14.175 1.00 12.52 N ATOM 1342 CA SER A 96 53.423 46.610 14.110 1.00 18.77 C ATOM 1343 C SER A 96 53.316 47.247 12.734 1.00 18.82 C ATOM 1344 O SER A 96 52.586 48.225 12.573 1.00 19.14 O ATOM 1345 CB SER A 96 53.924 47.652 15.120 1.00 19.55 C ATOM 1346 OG SER A 96 55.254 48.012 14.802 1.00 21.08 O ATOM 1347 HA SER A 96 52.415 46.282 14.365 1.00 0.00 H ATOM 1348 HB2 SER A 96 53.891 47.230 16.125 1.00 0.00 H ATOM 1349 HB3 SER A 96 53.287 48.536 15.077 1.00 0.00 H ATOM 1350 HG SER A 96 55.831 47.208 14.842 1.00 0.00 H ATOM 1351 H SER A 96 55.113 45.400 14.693 1.00 0.00 H ATOM 1352 N SER A 97 53.975 46.718 11.724 1.00 20.13 N ATOM 1353 CA SER A 97 53.923 47.211 10.362 1.00 21.13 C ATOM 1354 C SER A 97 52.622 46.701 9.735 1.00 19.89 C ATOM 1355 O SER A 97 52.184 47.223 8.716 1.00 18.97 O ATOM 1356 CB SER A 97 55.162 46.779 9.577 1.00 18.00 C ATOM 1357 OG SER A 97 55.197 45.376 9.450 1.00 21.65 O ATOM 1358 HA SER A 97 53.927 48.301 10.343 1.00 0.00 H ATOM 1359 HB2 SER A 97 56.056 47.115 10.102 1.00 0.00 H ATOM 1360 HB3 SER A 97 55.134 47.229 8.585 1.00 0.00 H ATOM 1361 HG SER A 97 56.004 45.112 8.940 1.00 0.00 H ATOM 1362 H SER A 97 54.574 45.890 11.917 1.00 0.00 H ATOM 1363 N TYR A 98 51.984 45.703 10.338 1.00 16.96 N ATOM 1364 CA TYR A 98 50.736 45.200 9.796 1.00 16.68 C ATOM 1365 C TYR A 98 49.565 45.980 10.381 1.00 17.36 C ATOM 1366 O TYR A 98 49.634 46.559 11.468 1.00 18.44 O ATOM 1367 CB TYR A 98 50.521 43.711 10.066 1.00 16.32 C ATOM 1368 CG TYR A 98 51.517 42.916 9.262 1.00 16.85 C ATOM 1369 CD1 TYR A 98 52.760 42.625 9.810 1.00 19.16 C ATOM 1370 CD2 TYR A 98 51.218 42.500 7.979 1.00 16.89 C ATOM 1371 CE1 TYR A 98 53.690 41.897 9.088 1.00 17.50 C ATOM 1372 CE2 TYR A 98 52.142 41.775 7.247 1.00 18.15 C ATOM 1373 CZ TYR A 98 53.371 41.497 7.812 1.00 18.37 C ATOM 1374 OH TYR A 98 54.292 40.780 7.092 1.00 21.45 O ATOM 1375 HA TYR A 98 50.792 45.334 8.716 1.00 0.00 H ATOM 1376 HB3 TYR A 98 49.509 43.429 9.776 1.00 0.00 H ATOM 1377 HB2 TYR A 98 50.663 43.508 11.127 1.00 0.00 H ATOM 1378 HD2 TYR A 98 50.250 42.744 7.541 1.00 0.00 H ATOM 1379 HE2 TYR A 98 51.904 41.429 6.241 1.00 0.00 H ATOM 1380 HE1 TYR A 98 54.657 41.646 9.523 1.00 0.00 H ATOM 1381 HD1 TYR A 98 53.004 42.972 10.814 1.00 0.00 H ATOM 1382 HH TYR A 98 54.508 41.267 6.258 1.00 0.00 H ATOM 1383 H TYR A 98 52.381 45.281 11.202 1.00 0.00 H ATOM 1384 N GLU A 99 48.481 45.957 9.612 1.00 16.15 N ATOM 1385 CA GLU A 99 47.295 46.663 10.059 1.00 17.37 C ATOM 1386 C GLU A 99 46.712 46.115 11.363 1.00 13.86 C ATOM 1387 O GLU A 99 46.302 46.901 12.223 1.00 13.69 O ATOM 1388 CB GLU A 99 46.226 46.641 8.958 1.00 21.26 C ATOM 1389 CG GLU A 99 45.119 47.588 9.441 1.00 36.78 C ATOM 1390 CD GLU A 99 44.152 47.971 8.353 1.00 46.43 C ATOM 1391 OE1 GLU A 99 44.215 47.311 7.292 1.00 53.39 O ATOM 1392 OE2 GLU A 99 43.374 48.916 8.605 1.00 56.83 O ATOM 1393 HA GLU A 99 47.605 47.687 10.265 1.00 0.00 H ATOM 1394 HB2 GLU A 99 46.643 46.993 8.014 1.00 0.00 H ATOM 1395 HB3 GLU A 99 45.834 45.632 8.827 1.00 0.00 H ATOM 1396 HG2 GLU A 99 44.565 47.095 10.240 1.00 0.00 H ATOM 1397 HG3 GLU A 99 45.583 48.495 9.828 1.00 0.00 H ATOM 1398 H GLU A 99 48.483 45.443 8.708 1.00 0.00 H ATOM 1399 N TYR A 100 46.642 44.812 11.524 1.00 12.89 N ATOM 1400 CA TYR A 100 46.102 44.219 12.753 1.00 13.64 C ATOM 1401 C TYR A 100 47.286 43.693 13.570 1.00 11.75 C ATOM 1402 O TYR A 100 47.567 42.501 13.509 1.00 12.96 O ATOM 1403 CB TYR A 100 45.074 43.147 12.392 1.00 14.94 C ATOM 1404 CG TYR A 100 43.937 43.677 11.542 1.00 16.94 C ATOM 1405 CD1 TYR A 100 42.975 44.503 12.099 1.00 17.58 C ATOM 1406 CD2 TYR A 100 43.871 43.392 10.177 1.00 18.64 C ATOM 1407 CE1 TYR A 100 41.946 45.010 11.318 1.00 18.94 C ATOM 1408 CE2 TYR A 100 42.848 43.890 9.380 1.00 19.48 C ATOM 1409 CZ TYR A 100 41.897 44.701 9.966 1.00 19.82 C ATOM 1410 OH TYR A 100 40.864 45.213 9.227 1.00 15.22 O ATOM 1411 HA TYR A 100 45.570 44.946 13.366 1.00 0.00 H ATOM 1412 HB3 TYR A 100 44.658 42.740 13.314 1.00 0.00 H ATOM 1413 HB2 TYR A 100 45.579 42.353 11.841 1.00 0.00 H ATOM 1414 HD2 TYR A 100 44.640 42.764 9.726 1.00 0.00 H ATOM 1415 HE2 TYR A 100 42.798 43.647 8.319 1.00 0.00 H ATOM 1416 HE1 TYR A 100 41.182 45.647 11.763 1.00 0.00 H ATOM 1417 HD1 TYR A 100 43.026 44.757 13.158 1.00 0.00 H ATOM 1418 HH TYR A 100 41.228 45.771 8.495 1.00 0.00 H ATOM 1419 H TYR A 100 46.977 44.187 10.763 1.00 0.00 H ATOM 1420 N PHE A 101 47.998 44.547 14.291 1.00 11.70 N ATOM 1421 CA PHE A 101 49.158 44.110 15.076 1.00 13.00 C ATOM 1422 C PHE A 101 48.747 43.193 16.216 1.00 14.08 C ATOM 1423 O PHE A 101 47.961 43.586 17.099 1.00 14.06 O ATOM 1424 CB PHE A 101 49.837 45.344 15.653 1.00 14.60 C ATOM 1425 CG PHE A 101 50.893 45.065 16.686 1.00 18.21 C ATOM 1426 CD1 PHE A 101 51.943 44.227 16.404 1.00 14.31 C ATOM 1427 CD2 PHE A 101 50.836 45.629 17.951 1.00 19.60 C ATOM 1428 CE1 PHE A 101 52.950 43.962 17.306 1.00 14.55 C ATOM 1429 CE2 PHE A 101 51.836 45.368 18.882 1.00 16.42 C ATOM 1430 CZ PHE A 101 52.882 44.536 18.560 1.00 14.71 C ATOM 1431 HA PHE A 101 49.833 43.556 14.424 1.00 0.00 H ATOM 1432 HB2 PHE A 101 50.303 45.889 14.832 1.00 0.00 H ATOM 1433 HB3 PHE A 101 49.071 45.968 16.113 1.00 0.00 H ATOM 1434 HD2 PHE A 101 50.004 46.280 18.217 1.00 0.00 H ATOM 1435 HE2 PHE A 101 51.790 45.825 19.871 1.00 0.00 H ATOM 1436 HZ PHE A 101 53.659 44.329 19.296 1.00 0.00 H ATOM 1437 HE1 PHE A 101 53.783 43.313 17.035 1.00 0.00 H ATOM 1438 HD1 PHE A 101 51.982 43.751 15.424 1.00 0.00 H ATOM 1439 H PHE A 101 47.728 45.551 14.301 1.00 0.00 H ATOM 1440 N CYS A 102 49.214 41.946 16.221 1.00 11.23 N ATOM 1441 CA CYS A 102 48.845 40.989 17.260 1.00 11.89 C ATOM 1442 C CYS A 102 47.338 40.846 17.364 1.00 12.75 C ATOM 1443 O CYS A 102 46.831 40.577 18.449 1.00 11.19 O ATOM 1444 CB CYS A 102 49.441 41.343 18.632 1.00 8.48 C ATOM 1445 SG CYS A 102 51.188 40.960 18.673 1.00 12.77 S ATOM 1446 HA CYS A 102 49.271 40.032 16.958 1.00 0.00 H ATOM 1447 HB2 CYS A 102 48.929 40.769 19.405 1.00 0.00 H ATOM 1448 HB3 CYS A 102 49.302 42.408 18.820 1.00 0.00 H ATOM 1449 HG CYS A 102 51.700 41.286 19.912 1.00 0.00 H ATOM 1450 H CYS A 102 49.860 41.645 15.463 1.00 0.00 H ATOM 1451 N GLY A 103 46.633 40.929 16.224 1.00 9.35 N ATOM 1452 CA GLY A 103 45.206 40.791 16.174 1.00 6.72 C ATOM 1453 C GLY A 103 44.754 39.445 16.714 1.00 8.00 C ATOM 1454 O GLY A 103 43.601 39.357 17.182 1.00 11.32 O ATOM 1455 HA3 GLY A 103 44.877 40.885 15.139 1.00 0.00 H ATOM 1456 HA2 GLY A 103 44.753 41.582 16.771 1.00 0.00 H ATOM 1457 H GLY A 103 47.146 41.101 15.336 1.00 0.00 H ATOM 1458 N ALA A 104 45.538 38.376 16.662 1.00 9.91 N ATOM 1459 CA ALA A 104 45.121 37.091 17.211 1.00 11.48 C ATOM 1460 C ALA A 104 44.917 37.200 18.739 1.00 11.54 C ATOM 1461 O ALA A 104 43.982 36.566 19.228 1.00 12.06 O ATOM 1462 CB ALA A 104 46.114 35.975 16.917 1.00 9.97 C ATOM 1463 HA ALA A 104 44.181 36.836 16.722 1.00 0.00 H ATOM 1464 HB1 ALA A 104 46.219 35.859 15.838 1.00 0.00 H ATOM 1465 HB2 ALA A 104 47.081 36.227 17.353 1.00 0.00 H ATOM 1466 HB3 ALA A 104 45.750 35.043 17.350 1.00 0.00 H ATOM 1467 H ALA A 104 46.475 38.457 16.218 1.00 0.00 H ATOM 1468 N VAL A 105 45.783 37.945 19.424 1.00 12.53 N ATOM 1469 CA VAL A 105 45.692 38.136 20.883 1.00 12.90 C ATOM 1470 C VAL A 105 44.334 38.778 21.190 1.00 13.49 C ATOM 1471 O VAL A 105 43.608 38.275 22.059 1.00 14.41 O ATOM 1472 CB VAL A 105 46.842 38.958 21.499 1.00 15.37 C ATOM 1473 CG1 VAL A 105 46.685 39.101 23.026 1.00 13.31 C ATOM 1474 CG2 VAL A 105 48.172 38.323 21.163 1.00 10.50 C ATOM 1475 HA VAL A 105 45.785 37.155 21.348 1.00 0.00 H ATOM 1476 HB VAL A 105 46.805 39.959 21.070 1.00 0.00 H ATOM 1477 HG11 VAL A 105 45.744 39.605 23.248 1.00 0.00 H ATOM 1478 HG12 VAL A 105 46.685 38.112 23.484 1.00 0.00 H ATOM 1479 HG13 VAL A 105 47.515 39.686 23.422 1.00 0.00 H ATOM 1480 HG21 VAL A 105 48.201 37.310 21.564 1.00 0.00 H ATOM 1481 HG22 VAL A 105 48.295 38.291 20.080 1.00 0.00 H ATOM 1482 HG23 VAL A 105 48.976 38.912 21.603 1.00 0.00 H ATOM 1483 H VAL A 105 46.556 38.412 18.908 1.00 0.00 H ATOM 1484 N ASP A 106 43.943 39.851 20.482 1.00 11.68 N ATOM 1485 CA ASP A 106 42.656 40.473 20.694 1.00 12.52 C ATOM 1486 C ASP A 106 41.493 39.528 20.418 1.00 11.06 C ATOM 1487 O ASP A 106 40.539 39.518 21.204 1.00 12.08 O ATOM 1488 CB ASP A 106 42.455 41.720 19.823 1.00 16.36 C ATOM 1489 CG ASP A 106 43.541 42.746 19.974 1.00 20.48 C ATOM 1490 OD1 ASP A 106 44.232 42.816 21.003 1.00 29.88 O ATOM 1491 OD2 ASP A 106 43.772 43.520 19.031 1.00 26.72 O ATOM 1492 HA ASP A 106 42.660 40.753 21.747 1.00 0.00 H ATOM 1493 HB2 ASP A 106 42.419 41.408 18.779 1.00 0.00 H ATOM 1494 HB3 ASP A 106 41.506 42.181 20.096 1.00 0.00 H ATOM 1495 H ASP A 106 44.583 40.244 19.763 1.00 0.00 H ATOM 1496 N ALA A 107 41.492 38.737 19.353 1.00 10.65 N ATOM 1497 CA ALA A 107 40.417 37.833 19.029 1.00 11.21 C ATOM 1498 C ALA A 107 40.255 36.749 20.103 1.00 12.84 C ATOM 1499 O ALA A 107 39.140 36.362 20.445 1.00 8.70 O ATOM 1500 CB ALA A 107 40.668 37.195 17.653 1.00 9.54 C ATOM 1501 HA ALA A 107 39.489 38.404 18.995 1.00 0.00 H ATOM 1502 HB1 ALA A 107 40.722 37.977 16.896 1.00 0.00 H ATOM 1503 HB2 ALA A 107 41.608 36.644 17.676 1.00 0.00 H ATOM 1504 HB3 ALA A 107 39.851 36.513 17.416 1.00 0.00 H ATOM 1505 H ALA A 107 42.313 38.771 18.716 1.00 0.00 H ATOM 1506 N ILE A 108 41.345 36.214 20.632 1.00 12.42 N ATOM 1507 CA ILE A 108 41.341 35.189 21.668 1.00 12.93 C ATOM 1508 C ILE A 108 40.840 35.797 22.983 1.00 10.59 C ATOM 1509 O ILE A 108 40.017 35.148 23.643 1.00 12.98 O ATOM 1510 CB ILE A 108 42.705 34.501 21.857 1.00 11.86 C ATOM 1511 CG1 ILE A 108 43.108 33.795 20.554 1.00 11.86 C ATOM 1512 CG2 ILE A 108 42.697 33.487 23.005 1.00 11.83 C ATOM 1513 CD1 ILE A 108 44.618 33.593 20.488 1.00 13.47 C ATOM 1514 HA ILE A 108 40.662 34.401 21.342 1.00 0.00 H ATOM 1515 HB ILE A 108 43.428 35.276 22.112 1.00 0.00 H ATOM 1516 HG12 ILE A 108 42.615 32.824 20.507 1.00 0.00 H ATOM 1517 HG13 ILE A 108 42.792 34.403 19.706 1.00 0.00 H ATOM 1518 HD11 ILE A 108 45.115 34.562 20.530 1.00 0.00 H ATOM 1519 HD12 ILE A 108 44.939 32.982 21.332 1.00 0.00 H ATOM 1520 HD13 ILE A 108 44.876 33.091 19.555 1.00 0.00 H ATOM 1521 HG21 ILE A 108 42.445 33.996 23.936 1.00 0.00 H ATOM 1522 HG22 ILE A 108 41.956 32.714 22.800 1.00 0.00 H ATOM 1523 HG23 ILE A 108 43.684 33.032 23.093 1.00 0.00 H ATOM 1524 H ILE A 108 42.267 36.548 20.284 1.00 0.00 H ATOM 1525 N GLU A 109 41.277 37.006 23.332 1.00 9.66 N ATOM 1526 CA GLU A 109 40.795 37.633 24.564 1.00 12.37 C ATOM 1527 C GLU A 109 39.289 37.872 24.527 1.00 15.78 C ATOM 1528 O GLU A 109 38.538 37.662 25.484 1.00 13.96 O ATOM 1529 CB GLU A 109 41.498 38.959 24.826 1.00 11.57 C ATOM 1530 CG GLU A 109 42.939 38.755 25.290 1.00 16.21 C ATOM 1531 CD GLU A 109 43.596 40.046 25.720 1.00 21.42 C ATOM 1532 OE1 GLU A 109 43.085 41.151 25.463 1.00 24.74 O ATOM 1533 OE2 GLU A 109 44.681 39.972 26.342 1.00 24.16 O ATOM 1534 HA GLU A 109 41.024 36.937 25.371 1.00 0.00 H ATOM 1535 HB2 GLU A 109 41.503 39.544 23.906 1.00 0.00 H ATOM 1536 HB3 GLU A 109 40.952 39.502 25.598 1.00 0.00 H ATOM 1537 HG2 GLU A 109 42.941 38.064 26.133 1.00 0.00 H ATOM 1538 HG3 GLU A 109 43.514 38.326 24.469 1.00 0.00 H ATOM 1539 H GLU A 109 41.961 37.505 22.729 1.00 0.00 H ATOM 1540 N GLU A 110 38.781 38.356 23.390 1.00 12.63 N ATOM 1541 CA GLU A 110 37.368 38.630 23.170 1.00 13.18 C ATOM 1542 C GLU A 110 36.536 37.368 23.326 1.00 12.96 C ATOM 1543 O GLU A 110 35.495 37.364 23.989 1.00 13.65 O ATOM 1544 CB GLU A 110 37.276 39.215 21.752 1.00 13.83 C ATOM 1545 CG GLU A 110 35.888 39.647 21.350 1.00 26.95 C ATOM 1546 CD GLU A 110 35.549 41.000 21.934 1.00 34.37 C ATOM 1547 OE1 GLU A 110 36.469 41.641 22.474 1.00 41.77 O ATOM 1548 OE2 GLU A 110 34.376 41.396 21.847 1.00 38.03 O ATOM 1549 HA GLU A 110 36.970 39.330 23.904 1.00 0.00 H ATOM 1550 HB2 GLU A 110 37.934 40.082 21.696 1.00 0.00 H ATOM 1551 HB3 GLU A 110 37.616 38.457 21.046 1.00 0.00 H ATOM 1552 HG2 GLU A 110 35.833 39.704 20.263 1.00 0.00 H ATOM 1553 HG3 GLU A 110 35.168 38.913 21.711 1.00 0.00 H ATOM 1554 H GLU A 110 39.440 38.550 22.609 1.00 0.00 H ATOM 1555 N LYS A 111 36.954 36.238 22.744 1.00 11.98 N ATOM 1556 CA LYS A 111 36.225 34.990 22.854 1.00 12.88 C ATOM 1557 C LYS A 111 36.229 34.493 24.299 1.00 16.62 C ATOM 1558 O LYS A 111 35.198 34.050 24.803 1.00 14.71 O ATOM 1559 CB LYS A 111 36.798 33.867 21.980 1.00 12.00 C ATOM 1560 CG LYS A 111 35.785 32.744 21.844 1.00 17.82 C ATOM 1561 CD LYS A 111 36.181 31.738 20.783 1.00 21.59 C ATOM 1562 CE LYS A 111 34.988 30.837 20.519 1.00 27.39 C ATOM 1563 NZ LYS A 111 35.289 29.735 19.555 1.00 36.23 N ATOM 1564 HA LYS A 111 35.216 35.215 22.510 1.00 0.00 H ATOM 1565 HB2 LYS A 111 37.033 34.263 20.992 1.00 0.00 H ATOM 1566 HB3 LYS A 111 37.707 33.479 22.440 1.00 0.00 H ATOM 1567 HG2 LYS A 111 35.701 32.230 22.801 1.00 0.00 H ATOM 1568 HG3 LYS A 111 34.819 33.173 21.577 1.00 0.00 H ATOM 1569 HD2 LYS A 111 36.462 32.258 19.867 1.00 0.00 H ATOM 1570 HD3 LYS A 111 37.024 31.142 21.134 1.00 0.00 H ATOM 1571 HE2 LYS A 111 34.178 31.443 20.112 1.00 0.00 H ATOM 1572 HE3 LYS A 111 34.670 30.395 21.464 1.00 0.00 H ATOM 1573 HZ1 LYS A 111 35.584 30.143 18.645 1.00 0.00 H ATOM 1574 HZ2 LYS A 111 36.054 29.143 19.936 1.00 0.00 H ATOM 1575 HZ3 LYS A 111 34.437 29.155 19.416 1.00 0.00 H ATOM 1576 H LYS A 111 37.835 36.256 22.192 1.00 0.00 H ATOM 1577 N LEU A 112 37.392 34.557 24.944 1.00 16.41 N ATOM 1578 CA LEU A 112 37.537 34.129 26.349 1.00 16.96 C ATOM 1579 C LEU A 112 36.610 34.935 27.252 1.00 13.28 C ATOM 1580 O LEU A 112 35.909 34.313 28.051 1.00 15.02 O ATOM 1581 CB LEU A 112 38.988 34.270 26.811 1.00 14.40 C ATOM 1582 CG LEU A 112 39.947 33.187 26.308 1.00 13.41 C ATOM 1583 CD1 LEU A 112 41.378 33.592 26.603 1.00 16.00 C ATOM 1584 CD2 LEU A 112 39.622 31.834 26.925 1.00 18.00 C ATOM 1585 HA LEU A 112 37.257 33.078 26.415 1.00 0.00 H ATOM 1586 HB2 LEU A 112 39.359 35.235 26.465 1.00 0.00 H ATOM 1587 HB3 LEU A 112 38.998 34.248 27.901 1.00 0.00 H ATOM 1588 HG LEU A 112 39.826 33.088 25.229 1.00 0.00 H ATOM 1589 HD21 LEU A 112 39.709 31.900 28.009 1.00 0.00 H ATOM 1590 HD22 LEU A 112 38.604 31.549 26.658 1.00 0.00 H ATOM 1591 HD23 LEU A 112 40.320 31.087 26.548 1.00 0.00 H ATOM 1592 HD11 LEU A 112 41.599 34.533 26.099 1.00 0.00 H ATOM 1593 HD12 LEU A 112 41.505 33.716 27.678 1.00 0.00 H ATOM 1594 HD13 LEU A 112 42.055 32.817 26.243 1.00 0.00 H ATOM 1595 H LEU A 112 38.226 34.921 24.441 1.00 0.00 H ATOM 1596 N LYS A 113 36.553 36.248 27.112 1.00 14.71 N ATOM 1597 CA LYS A 113 35.643 37.048 27.910 1.00 20.07 C ATOM 1598 C LYS A 113 34.198 36.678 27.566 1.00 23.31 C ATOM 1599 O LYS A 113 33.388 36.577 28.511 1.00 19.46 O ATOM 1600 CB LYS A 113 35.871 38.534 27.867 1.00 27.31 C ATOM 1601 CG LYS A 113 35.544 39.315 26.628 1.00 50.95 C ATOM 1602 CD LYS A 113 35.781 40.804 26.888 1.00 64.70 C ATOM 1603 CE LYS A 113 36.054 41.583 25.607 1.00 71.32 C ATOM 1604 NZ LYS A 113 37.523 41.593 25.286 1.00 75.46 N ATOM 1605 HA LYS A 113 35.857 36.796 28.949 1.00 0.00 H ATOM 1606 HB2 LYS A 113 35.280 38.965 28.675 1.00 0.00 H ATOM 1607 HB3 LYS A 113 36.930 38.695 28.068 1.00 0.00 H ATOM 1608 HG2 LYS A 113 36.182 38.982 25.809 1.00 0.00 H ATOM 1609 HG3 LYS A 113 34.499 39.154 26.361 1.00 0.00 H ATOM 1610 HD2 LYS A 113 34.896 41.221 27.369 1.00 0.00 H ATOM 1611 HD3 LYS A 113 36.638 40.911 27.552 1.00 0.00 H ATOM 1612 HE2 LYS A 113 35.709 42.609 25.733 1.00 0.00 H ATOM 1613 HE3 LYS A 113 35.512 41.118 24.784 1.00 0.00 H ATOM 1614 HZ1 LYS A 113 38.044 42.040 26.067 1.00 0.00 H ATOM 1615 HZ2 LYS A 113 37.856 40.616 25.160 1.00 0.00 H ATOM 1616 HZ3 LYS A 113 37.681 42.130 24.409 1.00 0.00 H ATOM 1617 H LYS A 113 37.171 36.716 26.418 1.00 0.00 H ATOM 1618 N ASN A 114 33.836 36.406 26.305 1.00 19.33 N ATOM 1619 CA ASN A 114 32.465 36.010 26.004 1.00 22.09 C ATOM 1620 C ASN A 114 32.135 34.638 26.625 1.00 18.94 C ATOM 1621 O ASN A 114 30.961 34.362 26.860 1.00 18.25 O ATOM 1622 CB ASN A 114 32.059 35.887 24.523 1.00 24.45 C ATOM 1623 CG ASN A 114 32.205 37.144 23.684 1.00 23.32 C ATOM 1624 OD1 ASN A 114 32.467 37.010 22.479 1.00 24.63 O ATOM 1625 ND2 ASN A 114 32.063 38.284 24.325 1.00 20.79 N ATOM 1626 HA ASN A 114 31.910 36.848 26.427 1.00 0.00 H ATOM 1627 HB2 ASN A 114 32.677 35.111 24.071 1.00 0.00 H ATOM 1628 HB3 ASN A 114 31.013 35.583 24.488 1.00 0.00 H ATOM 1629 HD22 ASN A 114 31.842 38.285 25.341 1.00 0.00 H ATOM 1630 HD21 ASN A 114 32.171 39.184 23.815 1.00 0.00 H ATOM 1631 H ASN A 114 34.535 36.477 25.538 1.00 0.00 H ATOM 1632 N LEU A 115 33.110 33.782 26.856 1.00 16.67 N ATOM 1633 CA LEU A 115 32.925 32.475 27.451 1.00 17.88 C ATOM 1634 C LEU A 115 32.967 32.518 28.984 1.00 18.12 C ATOM 1635 O LEU A 115 32.857 31.470 29.619 1.00 21.53 O ATOM 1636 CB LEU A 115 34.013 31.498 26.992 1.00 15.57 C ATOM 1637 CG LEU A 115 33.921 31.016 25.546 1.00 14.83 C ATOM 1638 CD1 LEU A 115 35.073 30.091 25.236 1.00 16.26 C ATOM 1639 CD2 LEU A 115 32.588 30.338 25.302 1.00 15.38 C ATOM 1640 HA LEU A 115 31.941 32.141 27.122 1.00 0.00 H ATOM 1641 HB2 LEU A 115 34.977 31.991 27.118 1.00 0.00 H ATOM 1642 HB3 LEU A 115 33.967 30.622 27.638 1.00 0.00 H ATOM 1643 HG LEU A 115 33.986 31.874 24.877 1.00 0.00 H ATOM 1644 HD21 LEU A 115 32.489 29.482 25.970 1.00 0.00 H ATOM 1645 HD22 LEU A 115 31.781 31.046 25.494 1.00 0.00 H ATOM 1646 HD23 LEU A 115 32.538 30.000 24.267 1.00 0.00 H ATOM 1647 HD11 LEU A 115 36.013 30.624 25.378 1.00 0.00 H ATOM 1648 HD12 LEU A 115 35.037 29.231 25.904 1.00 0.00 H ATOM 1649 HD13 LEU A 115 34.998 29.753 24.202 1.00 0.00 H ATOM 1650 H LEU A 115 34.076 34.064 26.594 1.00 0.00 H ATOM 1651 N GLY A 116 33.153 33.665 29.609 1.00 18.05 N ATOM 1652 CA GLY A 116 33.191 33.808 31.045 1.00 19.88 C ATOM 1653 C GLY A 116 34.498 33.531 31.760 1.00 23.02 C ATOM 1654 O GLY A 116 34.503 33.290 32.989 1.00 23.07 O ATOM 1655 HA3 GLY A 116 32.447 33.127 31.457 1.00 0.00 H ATOM 1656 HA2 GLY A 116 32.908 34.835 31.275 1.00 0.00 H ATOM 1657 H GLY A 116 33.280 34.520 29.031 1.00 0.00 H ATOM 1658 N ALA A 117 35.611 33.522 31.029 1.00 19.14 N ATOM 1659 CA ALA A 117 36.917 33.298 31.639 1.00 16.42 C ATOM 1660 C ALA A 117 37.236 34.606 32.361 1.00 15.84 C ATOM 1661 O ALA A 117 36.643 35.656 32.090 1.00 14.71 O ATOM 1662 CB ALA A 117 38.007 33.042 30.598 1.00 12.92 C ATOM 1663 HA ALA A 117 36.890 32.424 32.289 1.00 0.00 H ATOM 1664 HB1 ALA A 117 37.750 32.158 30.015 1.00 0.00 H ATOM 1665 HB2 ALA A 117 38.086 33.905 29.937 1.00 0.00 H ATOM 1666 HB3 ALA A 117 38.959 32.881 31.103 1.00 0.00 H ATOM 1667 H ALA A 117 35.548 33.678 30.003 1.00 0.00 H ATOM 1668 N GLU A 118 38.198 34.536 33.261 1.00 15.18 N ATOM 1669 CA GLU A 118 38.604 35.752 33.971 1.00 17.75 C ATOM 1670 C GLU A 118 39.997 36.109 33.454 1.00 14.75 C ATOM 1671 O GLU A 118 40.953 35.384 33.723 1.00 16.17 O ATOM 1672 CB GLU A 118 38.568 35.425 35.450 1.00 31.15 C ATOM 1673 CG GLU A 118 39.158 36.463 36.384 1.00 48.66 C ATOM 1674 CD GLU A 118 38.994 36.032 37.840 1.00 58.14 C ATOM 1675 OE1 GLU A 118 37.923 35.446 38.135 1.00 61.69 O ATOM 1676 OE2 GLU A 118 39.936 36.287 38.622 1.00 62.17 O ATOM 1677 HA GLU A 118 37.956 36.613 33.808 1.00 0.00 H ATOM 1678 HB2 GLU A 118 37.525 35.279 35.732 1.00 0.00 H ATOM 1679 HB3 GLU A 118 39.117 34.495 35.598 1.00 0.00 H ATOM 1680 HG2 GLU A 118 40.219 36.583 36.163 1.00 0.00 H ATOM 1681 HG3 GLU A 118 38.647 37.414 36.232 1.00 0.00 H ATOM 1682 H GLU A 118 38.663 33.628 33.464 1.00 0.00 H ATOM 1683 N ILE A 119 40.101 37.168 32.675 1.00 14.97 N ATOM 1684 CA ILE A 119 41.391 37.587 32.112 1.00 16.38 C ATOM 1685 C ILE A 119 42.128 38.272 33.260 1.00 16.87 C ATOM 1686 O ILE A 119 41.664 39.316 33.744 1.00 18.89 O ATOM 1687 CB ILE A 119 41.188 38.569 30.951 1.00 20.78 C ATOM 1688 CG1 ILE A 119 40.201 38.037 29.912 1.00 23.42 C ATOM 1689 CG2 ILE A 119 42.498 39.038 30.319 1.00 16.81 C ATOM 1690 CD1 ILE A 119 40.479 36.734 29.243 1.00 32.29 C ATOM 1691 HA ILE A 119 41.948 36.739 31.713 1.00 0.00 H ATOM 1692 HB ILE A 119 40.739 39.459 31.391 1.00 0.00 H ATOM 1693 HG12 ILE A 119 39.236 37.940 30.410 1.00 0.00 H ATOM 1694 HG13 ILE A 119 40.129 38.789 29.127 1.00 0.00 H ATOM 1695 HD11 ILE A 119 41.428 36.796 28.710 1.00 0.00 H ATOM 1696 HD12 ILE A 119 40.534 35.946 29.994 1.00 0.00 H ATOM 1697 HD13 ILE A 119 39.678 36.511 28.538 1.00 0.00 H ATOM 1698 HG21 ILE A 119 43.104 39.541 31.073 1.00 0.00 H ATOM 1699 HG22 ILE A 119 43.041 38.177 29.930 1.00 0.00 H ATOM 1700 HG23 ILE A 119 42.280 39.730 29.505 1.00 0.00 H ATOM 1701 H ILE A 119 39.248 37.720 32.454 1.00 0.00 H ATOM 1702 N VAL A 120 43.231 37.720 33.717 1.00 17.48 N ATOM 1703 CA VAL A 120 43.918 38.328 34.860 1.00 19.10 C ATOM 1704 C VAL A 120 44.849 39.463 34.546 1.00 20.47 C ATOM 1705 O VAL A 120 45.108 40.266 35.443 1.00 19.93 O ATOM 1706 CB VAL A 120 44.587 37.215 35.703 1.00 20.44 C ATOM 1707 CG1 VAL A 120 43.552 36.204 36.198 1.00 21.08 C ATOM 1708 CG2 VAL A 120 45.662 36.483 34.938 1.00 18.52 C ATOM 1709 HA VAL A 120 43.147 38.827 35.447 1.00 0.00 H ATOM 1710 HB VAL A 120 45.050 37.715 36.554 1.00 0.00 H ATOM 1711 HG11 VAL A 120 42.814 36.715 36.816 1.00 0.00 H ATOM 1712 HG12 VAL A 120 43.056 35.745 35.343 1.00 0.00 H ATOM 1713 HG13 VAL A 120 44.051 35.434 36.787 1.00 0.00 H ATOM 1714 HG21 VAL A 120 45.225 36.020 34.053 1.00 0.00 H ATOM 1715 HG22 VAL A 120 46.436 37.189 34.636 1.00 0.00 H ATOM 1716 HG23 VAL A 120 46.099 35.713 35.574 1.00 0.00 H ATOM 1717 H VAL A 120 43.612 36.861 33.272 1.00 0.00 H ATOM 1718 N GLN A 121 45.371 39.627 33.343 1.00 18.11 N ATOM 1719 CA GLN A 121 46.288 40.683 32.960 1.00 18.03 C ATOM 1720 C GLN A 121 46.055 40.974 31.451 1.00 15.94 C ATOM 1721 O GLN A 121 45.631 40.077 30.746 1.00 16.57 O ATOM 1722 CB GLN A 121 47.728 40.192 32.991 1.00 25.79 C ATOM 1723 CG GLN A 121 48.701 40.250 34.119 1.00 39.22 C ATOM 1724 CD GLN A 121 48.985 41.678 34.544 1.00 45.89 C ATOM 1725 OE1 GLN A 121 48.642 42.055 35.663 1.00 52.56 O ATOM 1726 NE2 GLN A 121 49.580 42.459 33.653 1.00 52.30 N ATOM 1727 HA GLN A 121 46.128 41.527 33.631 1.00 0.00 H ATOM 1728 HB2 GLN A 121 47.662 39.133 32.739 1.00 0.00 H ATOM 1729 HB3 GLN A 121 48.218 40.728 32.178 1.00 0.00 H ATOM 1730 HG2 GLN A 121 48.290 39.704 34.968 1.00 0.00 H ATOM 1731 HG3 GLN A 121 49.634 39.783 33.805 1.00 0.00 H ATOM 1732 HE22 GLN A 121 49.845 42.078 32.722 1.00 0.00 H ATOM 1733 HE21 GLN A 121 49.782 43.453 33.885 1.00 0.00 H ATOM 1734 H GLN A 121 45.101 38.941 32.609 1.00 0.00 H ATOM 1735 N ASP A 122 46.333 42.179 31.021 1.00 16.51 N ATOM 1736 CA ASP A 122 46.215 42.560 29.611 1.00 17.99 C ATOM 1737 C ASP A 122 47.254 41.700 28.872 1.00 13.86 C ATOM 1738 O ASP A 122 48.320 41.439 29.422 1.00 13.67 O ATOM 1739 CB ASP A 122 46.487 44.037 29.378 1.00 26.43 C ATOM 1740 CG ASP A 122 45.502 44.981 30.041 1.00 40.38 C ATOM 1741 OD1 ASP A 122 44.292 44.663 30.147 1.00 46.59 O ATOM 1742 OD2 ASP A 122 45.935 46.080 30.475 1.00 50.74 O ATOM 1743 HA ASP A 122 45.199 42.394 29.254 1.00 0.00 H ATOM 1744 HB2 ASP A 122 47.482 44.263 29.761 1.00 0.00 H ATOM 1745 HB3 ASP A 122 46.462 44.221 28.304 1.00 0.00 H ATOM 1746 H ASP A 122 46.650 42.894 31.707 1.00 0.00 H ATOM 1747 N GLY A 123 46.922 41.253 27.682 1.00 13.36 N ATOM 1748 CA GLY A 123 47.788 40.380 26.928 1.00 11.91 C ATOM 1749 C GLY A 123 49.120 41.012 26.587 1.00 11.29 C ATOM 1750 O GLY A 123 49.240 42.230 26.461 1.00 13.80 O ATOM 1751 HA3 GLY A 123 47.285 40.109 26.000 1.00 0.00 H ATOM 1752 HA2 GLY A 123 47.971 39.481 27.516 1.00 0.00 H ATOM 1753 H GLY A 123 46.009 41.537 27.272 1.00 0.00 H ATOM 1754 N LEU A 124 50.106 40.137 26.436 1.00 12.11 N ATOM 1755 CA LEU A 124 51.471 40.559 26.091 1.00 11.10 C ATOM 1756 C LEU A 124 51.545 40.548 24.565 1.00 10.73 C ATOM 1757 O LEU A 124 51.341 39.478 23.981 1.00 11.61 O ATOM 1758 CB LEU A 124 52.477 39.584 26.697 1.00 9.97 C ATOM 1759 CG LEU A 124 53.963 39.777 26.341 1.00 12.84 C ATOM 1760 CD1 LEU A 124 54.491 41.087 26.895 1.00 15.44 C ATOM 1761 CD2 LEU A 124 54.751 38.586 26.862 1.00 15.34 C ATOM 1762 HA LEU A 124 51.706 41.550 26.481 1.00 0.00 H ATOM 1763 HB2 LEU A 124 52.389 39.657 27.781 1.00 0.00 H ATOM 1764 HB3 LEU A 124 52.193 38.581 26.377 1.00 0.00 H ATOM 1765 HG LEU A 124 54.077 39.829 25.258 1.00 0.00 H ATOM 1766 HD21 LEU A 124 54.635 38.521 27.944 1.00 0.00 H ATOM 1767 HD22 LEU A 124 54.376 37.673 26.400 1.00 0.00 H ATOM 1768 HD23 LEU A 124 55.805 38.713 26.615 1.00 0.00 H ATOM 1769 HD11 LEU A 124 53.920 41.915 26.474 1.00 0.00 H ATOM 1770 HD12 LEU A 124 54.389 41.089 27.980 1.00 0.00 H ATOM 1771 HD13 LEU A 124 55.542 41.196 26.628 1.00 0.00 H ATOM 1772 H LEU A 124 49.907 39.124 26.565 1.00 0.00 H ATOM 1773 N ARG A 125 51.811 41.676 23.951 1.00 10.64 N ATOM 1774 CA ARG A 125 51.887 41.809 22.485 1.00 13.20 C ATOM 1775 C ARG A 125 53.309 42.173 22.074 1.00 13.07 C ATOM 1776 O ARG A 125 53.747 43.299 22.304 1.00 16.82 O ATOM 1777 CB ARG A 125 50.851 42.866 22.077 1.00 10.40 C ATOM 1778 CG ARG A 125 49.412 42.348 22.217 1.00 12.33 C ATOM 1779 CD ARG A 125 48.442 43.516 22.120 1.00 17.55 C ATOM 1780 NE ARG A 125 47.060 43.084 22.264 1.00 22.65 N ATOM 1781 CZ ARG A 125 46.393 42.894 23.398 1.00 26.72 C ATOM 1782 NH1 ARG A 125 46.973 43.108 24.574 1.00 22.74 N ATOM 1783 NH2 ARG A 125 45.125 42.498 23.362 1.00 20.90 N ATOM 1784 HA ARG A 125 51.657 40.875 21.973 1.00 0.00 H ATOM 1785 HB2 ARG A 125 50.973 43.742 22.714 1.00 0.00 H ATOM 1786 HB3 ARG A 125 51.025 43.146 21.038 1.00 0.00 H ATOM 1787 HG2 ARG A 125 49.203 41.634 21.420 1.00 0.00 H ATOM 1788 HG3 ARG A 125 49.295 41.857 23.183 1.00 0.00 H ATOM 1789 HD2 ARG A 125 48.563 43.996 21.149 1.00 0.00 H ATOM 1790 HD3 ARG A 125 48.672 44.232 22.909 1.00 0.00 H ATOM 1791 HE ARG A 125 46.537 42.904 21.383 1.00 0.00 H ATOM 1792 HH12 ARG A 125 46.438 42.955 25.453 1.00 0.00 H ATOM 1793 HH11 ARG A 125 47.962 43.428 24.616 1.00 0.00 H ATOM 1794 HH22 ARG A 125 44.601 42.349 24.248 1.00 0.00 H ATOM 1795 HH21 ARG A 125 44.656 42.337 22.448 1.00 0.00 H ATOM 1796 H ARG A 125 51.977 42.523 24.530 1.00 0.00 H ATOM 1797 N ILE A 126 54.066 41.241 21.507 1.00 12.84 N ATOM 1798 CA ILE A 126 55.455 41.426 21.130 1.00 11.58 C ATOM 1799 C ILE A 126 55.613 41.819 19.664 1.00 12.53 C ATOM 1800 O ILE A 126 55.045 41.168 18.799 1.00 11.17 O ATOM 1801 CB ILE A 126 56.277 40.125 21.331 1.00 10.68 C ATOM 1802 CG1 ILE A 126 56.095 39.559 22.742 1.00 15.89 C ATOM 1803 CG2 ILE A 126 57.750 40.276 20.951 1.00 10.02 C ATOM 1804 CD1 ILE A 126 56.750 40.340 23.836 1.00 23.37 C ATOM 1805 HA ILE A 126 55.821 42.225 21.775 1.00 0.00 H ATOM 1806 HB ILE A 126 55.871 39.394 20.631 1.00 0.00 H ATOM 1807 HG12 ILE A 126 55.026 39.516 22.952 1.00 0.00 H ATOM 1808 HG13 ILE A 126 56.507 38.550 22.756 1.00 0.00 H ATOM 1809 HD11 ILE A 126 57.824 40.383 23.657 1.00 0.00 H ATOM 1810 HD12 ILE A 126 56.342 41.351 23.854 1.00 0.00 H ATOM 1811 HD13 ILE A 126 56.559 39.853 24.792 1.00 0.00 H ATOM 1812 HG21 ILE A 126 57.826 40.554 19.900 1.00 0.00 H ATOM 1813 HG22 ILE A 126 58.205 41.051 21.567 1.00 0.00 H ATOM 1814 HG23 ILE A 126 58.265 39.330 21.116 1.00 0.00 H ATOM 1815 H ILE A 126 53.633 40.314 21.320 1.00 0.00 H ATOM 1816 N ASP A 127 56.401 42.851 19.475 1.00 13.93 N ATOM 1817 CA ASP A 127 56.732 43.373 18.156 1.00 14.95 C ATOM 1818 C ASP A 127 58.142 42.916 17.783 1.00 15.45 C ATOM 1819 O ASP A 127 59.099 43.200 18.494 1.00 16.93 O ATOM 1820 CB ASP A 127 56.658 44.892 18.156 1.00 11.34 C ATOM 1821 CG ASP A 127 56.664 45.515 16.780 1.00 16.79 C ATOM 1822 OD1 ASP A 127 56.629 44.858 15.727 1.00 15.02 O ATOM 1823 OD2 ASP A 127 56.650 46.762 16.757 1.00 21.84 O ATOM 1824 HA ASP A 127 56.017 42.996 17.425 1.00 0.00 H ATOM 1825 HB2 ASP A 127 55.739 45.189 18.662 1.00 0.00 H ATOM 1826 HB3 ASP A 127 57.516 45.276 18.708 1.00 0.00 H ATOM 1827 H ASP A 127 56.810 43.320 20.309 1.00 0.00 H ATOM 1828 N GLY A 128 58.325 42.180 16.694 1.00 13.84 N ATOM 1829 CA GLY A 128 59.626 41.718 16.239 1.00 14.41 C ATOM 1830 C GLY A 128 60.163 40.498 16.976 1.00 14.05 C ATOM 1831 O GLY A 128 59.423 39.660 17.492 1.00 16.25 O ATOM 1832 HA3 GLY A 128 60.339 42.533 16.366 1.00 0.00 H ATOM 1833 HA2 GLY A 128 59.547 41.468 15.181 1.00 0.00 H ATOM 1834 H GLY A 128 57.489 41.919 16.133 1.00 0.00 H ATOM 1835 N ASP A 129 61.486 40.376 17.010 1.00 10.94 N ATOM 1836 CA ASP A 129 62.175 39.284 17.660 1.00 12.07 C ATOM 1837 C ASP A 129 61.941 39.389 19.175 1.00 11.96 C ATOM 1838 O ASP A 129 62.350 40.370 19.810 1.00 11.99 O ATOM 1839 CB ASP A 129 63.674 39.457 17.343 1.00 10.54 C ATOM 1840 CG ASP A 129 64.473 38.242 17.729 1.00 11.53 C ATOM 1841 OD1 ASP A 129 63.973 37.393 18.511 1.00 12.93 O ATOM 1842 OD2 ASP A 129 65.605 38.095 17.235 1.00 16.79 O ATOM 1843 HA ASP A 129 61.819 38.313 17.317 1.00 0.00 H ATOM 1844 HB2 ASP A 129 63.791 39.630 16.273 1.00 0.00 H ATOM 1845 HB3 ASP A 129 64.054 40.318 17.893 1.00 0.00 H ATOM 1846 H ASP A 129 62.058 41.108 16.542 1.00 0.00 H ATOM 1847 N PRO A 130 61.280 38.405 19.759 1.00 12.82 N ATOM 1848 CA PRO A 130 61.006 38.353 21.193 1.00 12.68 C ATOM 1849 C PRO A 130 62.277 38.281 22.031 1.00 12.42 C ATOM 1850 O PRO A 130 62.291 38.749 23.184 1.00 13.87 O ATOM 1851 CB PRO A 130 60.116 37.111 21.400 1.00 12.09 C ATOM 1852 CG PRO A 130 60.488 36.256 20.206 1.00 11.37 C ATOM 1853 CD PRO A 130 60.802 37.204 19.062 1.00 10.22 C ATOM 1854 HA PRO A 130 60.510 39.265 21.525 1.00 0.00 H ATOM 1855 HD3 PRO A 130 61.574 36.793 18.412 1.00 0.00 H ATOM 1856 HD2 PRO A 130 59.910 37.420 18.474 1.00 0.00 H ATOM 1857 HG3 PRO A 130 59.655 35.606 19.936 1.00 0.00 H ATOM 1858 HG2 PRO A 130 61.362 35.647 20.439 1.00 0.00 H ATOM 1859 HB2 PRO A 130 60.351 36.607 22.337 1.00 0.00 H ATOM 1860 HB3 PRO A 130 59.058 37.374 21.385 1.00 0.00 H ATOM 1861 N ARG A 131 63.400 37.764 21.519 1.00 10.52 N ATOM 1862 CA ARG A 131 64.665 37.671 22.251 1.00 11.66 C ATOM 1863 C ARG A 131 65.173 39.038 22.648 1.00 13.02 C ATOM 1864 O ARG A 131 65.883 39.251 23.630 1.00 16.07 O ATOM 1865 CB ARG A 131 65.694 36.885 21.428 1.00 11.81 C ATOM 1866 CG ARG A 131 65.194 35.481 21.137 1.00 9.68 C ATOM 1867 CD ARG A 131 65.970 34.842 19.982 1.00 10.26 C ATOM 1868 NE ARG A 131 65.302 33.594 19.633 1.00 17.24 N ATOM 1869 CZ ARG A 131 64.161 33.509 18.938 1.00 20.33 C ATOM 1870 NH1 ARG A 131 63.512 34.570 18.458 1.00 16.27 N ATOM 1871 NH2 ARG A 131 63.631 32.310 18.733 1.00 16.78 N ATOM 1872 HA ARG A 131 64.494 37.125 23.178 1.00 0.00 H ATOM 1873 HB2 ARG A 131 65.870 37.404 20.486 1.00 0.00 H ATOM 1874 HB3 ARG A 131 66.627 36.823 21.987 1.00 0.00 H ATOM 1875 HG2 ARG A 131 65.317 34.868 22.030 1.00 0.00 H ATOM 1876 HG3 ARG A 131 64.138 35.528 20.872 1.00 0.00 H ATOM 1877 HD2 ARG A 131 66.996 34.640 20.291 1.00 0.00 H ATOM 1878 HD3 ARG A 131 65.976 35.513 19.123 1.00 0.00 H ATOM 1879 HE ARG A 131 65.744 32.706 19.946 1.00 0.00 H ATOM 1880 HH12 ARG A 131 62.628 34.442 17.925 1.00 0.00 H ATOM 1881 HH11 ARG A 131 63.889 35.526 18.617 1.00 0.00 H ATOM 1882 HH22 ARG A 131 62.745 32.218 18.196 1.00 0.00 H ATOM 1883 HH21 ARG A 131 64.101 31.462 19.109 1.00 0.00 H ATOM 1884 H ARG A 131 63.373 37.407 20.543 1.00 0.00 H ATOM 1885 N ALA A 132 64.787 40.070 21.901 1.00 12.19 N ATOM 1886 CA ALA A 132 65.147 41.448 22.152 1.00 15.98 C ATOM 1887 C ALA A 132 64.163 42.138 23.101 1.00 15.58 C ATOM 1888 O ALA A 132 64.368 43.311 23.422 1.00 17.66 O ATOM 1889 CB ALA A 132 65.227 42.266 20.856 1.00 17.90 C ATOM 1890 HA ALA A 132 66.131 41.412 22.619 1.00 0.00 H ATOM 1891 HB1 ALA A 132 65.980 41.831 20.199 1.00 0.00 H ATOM 1892 HB2 ALA A 132 64.257 42.252 20.359 1.00 0.00 H ATOM 1893 HB3 ALA A 132 65.500 43.294 21.093 1.00 0.00 H ATOM 1894 H ALA A 132 64.183 39.871 21.078 1.00 0.00 H ATOM 1895 N ALA A 133 63.095 41.466 23.509 1.00 16.26 N ATOM 1896 CA ALA A 133 62.108 42.039 24.439 1.00 14.34 C ATOM 1897 C ALA A 133 62.003 41.079 25.632 1.00 14.48 C ATOM 1898 O ALA A 133 60.965 40.996 26.278 1.00 15.53 O ATOM 1899 CB ALA A 133 60.755 42.128 23.731 1.00 15.80 C ATOM 1900 HA ALA A 133 62.402 43.035 24.769 1.00 0.00 H ATOM 1901 HB1 ALA A 133 60.848 42.766 22.852 1.00 0.00 H ATOM 1902 HB2 ALA A 133 60.440 41.130 23.426 1.00 0.00 H ATOM 1903 HB3 ALA A 133 60.017 42.551 24.412 1.00 0.00 H ATOM 1904 H ALA A 133 62.949 40.498 23.159 1.00 0.00 H ATOM 1905 N ARG A 134 63.055 40.316 25.926 1.00 14.05 N ATOM 1906 CA ARG A 134 63.075 39.324 26.985 1.00 14.90 C ATOM 1907 C ARG A 134 62.741 39.919 28.348 1.00 16.97 C ATOM 1908 O ARG A 134 62.026 39.245 29.095 1.00 15.88 O ATOM 1909 CB ARG A 134 64.402 38.585 27.094 1.00 13.29 C ATOM 1910 CG ARG A 134 64.392 37.423 28.069 1.00 15.66 C ATOM 1911 CD ARG A 134 65.734 36.677 28.059 1.00 16.14 C ATOM 1912 NE ARG A 134 65.529 35.502 28.930 1.00 20.29 N ATOM 1913 CZ ARG A 134 65.692 35.542 30.251 1.00 23.55 C ATOM 1914 NH1 ARG A 134 66.083 36.657 30.851 1.00 22.13 N ATOM 1915 NH2 ARG A 134 65.457 34.440 30.958 1.00 27.17 N ATOM 1916 HA ARG A 134 62.302 38.611 26.699 1.00 0.00 H ATOM 1917 HB2 ARG A 134 64.661 38.201 26.107 1.00 0.00 H ATOM 1918 HB3 ARG A 134 65.163 39.295 27.417 1.00 0.00 H ATOM 1919 HG2 ARG A 134 64.204 37.803 29.073 1.00 0.00 H ATOM 1920 HG3 ARG A 134 63.598 36.731 27.789 1.00 0.00 H ATOM 1921 HD2 ARG A 134 66.528 37.312 28.453 1.00 0.00 H ATOM 1922 HD3 ARG A 134 65.990 36.363 27.047 1.00 0.00 H ATOM 1923 HE ARG A 134 65.244 34.603 28.492 1.00 0.00 H ATOM 1924 HH12 ARG A 134 66.207 36.676 31.883 1.00 0.00 H ATOM 1925 HH11 ARG A 134 66.266 37.513 30.289 1.00 0.00 H ATOM 1926 HH22 ARG A 134 65.578 34.449 31.991 1.00 0.00 H ATOM 1927 HH21 ARG A 134 65.152 33.569 30.478 1.00 0.00 H ATOM 1928 H ARG A 134 63.918 40.439 25.359 1.00 0.00 H ATOM 1929 N ASP A 135 63.214 41.114 28.657 1.00 15.49 N ATOM 1930 CA ASP A 135 62.892 41.728 29.946 1.00 17.28 C ATOM 1931 C ASP A 135 61.398 41.992 30.071 1.00 17.61 C ATOM 1932 O ASP A 135 60.869 41.888 31.183 1.00 14.44 O ATOM 1933 CB ASP A 135 63.692 43.007 30.181 1.00 20.72 C ATOM 1934 CG ASP A 135 65.109 42.669 30.631 1.00 32.99 C ATOM 1935 OD1 ASP A 135 65.441 41.478 30.851 1.00 36.51 O ATOM 1936 OD2 ASP A 135 65.920 43.608 30.791 1.00 43.55 O ATOM 1937 HA ASP A 135 63.177 41.017 30.721 1.00 0.00 H ATOM 1938 HB2 ASP A 135 63.735 43.580 29.255 1.00 0.00 H ATOM 1939 HB3 ASP A 135 63.202 43.602 30.952 1.00 0.00 H ATOM 1940 H ASP A 135 63.819 41.621 27.980 1.00 0.00 H ATOM 1941 N ASP A 136 60.694 42.329 28.998 1.00 13.03 N ATOM 1942 CA ASP A 136 59.273 42.562 29.005 1.00 13.07 C ATOM 1943 C ASP A 136 58.501 41.258 29.236 1.00 12.11 C ATOM 1944 O ASP A 136 57.451 41.302 29.869 1.00 12.52 O ATOM 1945 CB ASP A 136 58.764 43.109 27.674 1.00 17.11 C ATOM 1946 CG ASP A 136 59.233 44.505 27.346 1.00 30.73 C ATOM 1947 OD1 ASP A 136 59.675 45.257 28.234 1.00 32.26 O ATOM 1948 OD2 ASP A 136 59.162 44.882 26.151 1.00 40.15 O ATOM 1949 HA ASP A 136 59.108 43.283 29.806 1.00 0.00 H ATOM 1950 HB2 ASP A 136 59.102 42.442 26.881 1.00 0.00 H ATOM 1951 HB3 ASP A 136 57.674 43.115 27.703 1.00 0.00 H ATOM 1952 H ASP A 136 61.200 42.431 28.095 1.00 0.00 H ATOM 1953 N ILE A 137 59.010 40.154 28.696 1.00 11.09 N ATOM 1954 CA ILE A 137 58.376 38.852 28.825 1.00 11.83 C ATOM 1955 C ILE A 137 58.478 38.378 30.279 1.00 14.31 C ATOM 1956 O ILE A 137 57.513 37.864 30.836 1.00 12.99 O ATOM 1957 CB ILE A 137 58.983 37.768 27.925 1.00 10.14 C ATOM 1958 CG1 ILE A 137 58.838 38.187 26.441 1.00 15.00 C ATOM 1959 CG2 ILE A 137 58.303 36.424 28.139 1.00 9.82 C ATOM 1960 CD1 ILE A 137 59.824 37.463 25.535 1.00 11.68 C ATOM 1961 HA ILE A 137 57.342 38.991 28.510 1.00 0.00 H ATOM 1962 HB ILE A 137 60.036 37.663 28.185 1.00 0.00 H ATOM 1963 HG12 ILE A 137 57.825 37.959 26.110 1.00 0.00 H ATOM 1964 HG13 ILE A 137 59.012 39.260 26.361 1.00 0.00 H ATOM 1965 HD11 ILE A 137 60.842 37.691 25.852 1.00 0.00 H ATOM 1966 HD12 ILE A 137 59.654 36.388 25.600 1.00 0.00 H ATOM 1967 HD13 ILE A 137 59.680 37.793 24.506 1.00 0.00 H ATOM 1968 HG21 ILE A 137 58.423 36.119 29.178 1.00 0.00 H ATOM 1969 HG22 ILE A 137 57.242 36.514 27.906 1.00 0.00 H ATOM 1970 HG23 ILE A 137 58.758 35.680 27.485 1.00 0.00 H ATOM 1971 H ILE A 137 59.898 40.225 28.159 1.00 0.00 H ATOM 1972 N VAL A 138 59.669 38.571 30.839 1.00 13.23 N ATOM 1973 CA VAL A 138 59.952 38.209 32.236 1.00 14.35 C ATOM 1974 C VAL A 138 59.064 39.004 33.185 1.00 11.36 C ATOM 1975 O VAL A 138 58.458 38.472 34.112 1.00 13.25 O ATOM 1976 CB VAL A 138 61.456 38.387 32.532 1.00 13.87 C ATOM 1977 CG1 VAL A 138 61.706 38.391 34.043 1.00 20.47 C ATOM 1978 CG2 VAL A 138 62.237 37.259 31.858 1.00 12.35 C ATOM 1979 HA VAL A 138 59.715 37.157 32.397 1.00 0.00 H ATOM 1980 HB VAL A 138 61.794 39.344 32.134 1.00 0.00 H ATOM 1981 HG11 VAL A 138 61.154 39.213 34.499 1.00 0.00 H ATOM 1982 HG12 VAL A 138 61.369 37.445 34.468 1.00 0.00 H ATOM 1983 HG13 VAL A 138 62.772 38.517 34.233 1.00 0.00 H ATOM 1984 HG21 VAL A 138 61.897 36.300 32.249 1.00 0.00 H ATOM 1985 HG22 VAL A 138 62.068 37.295 30.782 1.00 0.00 H ATOM 1986 HG23 VAL A 138 63.300 37.381 32.065 1.00 0.00 H ATOM 1987 H VAL A 138 60.428 38.994 30.268 1.00 0.00 H ATOM 1988 N GLY A 139 58.942 40.300 32.971 1.00 12.91 N ATOM 1989 CA GLY A 139 58.159 41.279 33.678 1.00 10.84 C ATOM 1990 C GLY A 139 56.686 40.940 33.593 1.00 14.81 C ATOM 1991 O GLY A 139 56.019 41.005 34.630 1.00 13.51 O ATOM 1992 HA3 GLY A 139 58.328 42.261 33.236 1.00 0.00 H ATOM 1993 HA2 GLY A 139 58.464 41.295 34.724 1.00 0.00 H ATOM 1994 H GLY A 139 59.495 40.670 32.171 1.00 0.00 H ATOM 1995 N TRP A 140 56.185 40.555 32.414 1.00 12.64 N ATOM 1996 CA TRP A 140 54.777 40.192 32.297 1.00 10.17 C ATOM 1997 C TRP A 140 54.492 38.917 33.063 1.00 10.77 C ATOM 1998 O TRP A 140 53.444 38.824 33.708 1.00 14.11 O ATOM 1999 CB TRP A 140 54.439 39.983 30.826 1.00 9.11 C ATOM 2000 CG TRP A 140 53.010 39.748 30.501 1.00 7.97 C ATOM 2001 CD1 TRP A 140 52.057 40.714 30.326 1.00 9.60 C ATOM 2002 CD2 TRP A 140 52.351 38.501 30.263 1.00 10.09 C ATOM 2003 NE1 TRP A 140 50.840 40.150 30.017 1.00 9.28 N ATOM 2004 CE2 TRP A 140 50.994 38.785 29.962 1.00 6.61 C ATOM 2005 CE3 TRP A 140 52.766 37.168 30.257 1.00 9.30 C ATOM 2006 CZ2 TRP A 140 50.066 37.799 29.652 1.00 7.96 C ATOM 2007 CZ3 TRP A 140 51.830 36.195 29.977 1.00 9.69 C ATOM 2008 CH2 TRP A 140 50.489 36.501 29.667 1.00 8.97 C ATOM 2009 HA TRP A 140 54.167 40.994 32.714 1.00 0.00 H ATOM 2010 HB2 TRP A 140 54.761 40.872 30.283 1.00 0.00 H ATOM 2011 HB3 TRP A 140 55.005 39.120 30.475 1.00 0.00 H ATOM 2012 HE1 TRP A 140 49.954 40.669 29.853 1.00 0.00 H ATOM 2013 HD1 TRP A 140 52.237 41.785 30.419 1.00 0.00 H ATOM 2014 HZ2 TRP A 140 49.035 38.053 29.405 1.00 0.00 H ATOM 2015 HH2 TRP A 140 49.788 35.699 29.439 1.00 0.00 H ATOM 2016 HZ3 TRP A 140 52.138 35.150 29.996 1.00 0.00 H ATOM 2017 HE3 TRP A 140 53.802 36.904 30.468 1.00 0.00 H ATOM 2018 H TRP A 140 56.802 40.514 31.578 1.00 0.00 H ATOM 2019 N ALA A 141 55.381 37.929 33.052 1.00 11.45 N ATOM 2020 CA ALA A 141 55.219 36.656 33.758 1.00 15.49 C ATOM 2021 C ALA A 141 55.166 36.919 35.275 1.00 18.62 C ATOM 2022 O ALA A 141 54.365 36.334 36.008 1.00 16.80 O ATOM 2023 CB ALA A 141 56.287 35.627 33.409 1.00 10.12 C ATOM 2024 HA ALA A 141 54.279 36.215 33.427 1.00 0.00 H ATOM 2025 HB1 ALA A 141 56.250 35.415 32.340 1.00 0.00 H ATOM 2026 HB2 ALA A 141 57.269 36.022 33.669 1.00 0.00 H ATOM 2027 HB3 ALA A 141 56.103 34.710 33.969 1.00 0.00 H ATOM 2028 H ALA A 141 56.253 38.070 32.503 1.00 0.00 H ATOM 2029 N HIS A 142 55.987 37.865 35.729 1.00 17.62 N ATOM 2030 CA HIS A 142 56.029 38.267 37.127 1.00 20.86 C ATOM 2031 C HIS A 142 54.672 38.826 37.538 1.00 21.11 C ATOM 2032 O HIS A 142 54.095 38.431 38.557 1.00 23.09 O ATOM 2033 CB HIS A 142 57.126 39.308 37.347 1.00 27.61 C ATOM 2034 CG HIS A 142 57.177 39.712 38.788 1.00 44.08 C ATOM 2035 ND1 HIS A 142 58.162 39.243 39.632 1.00 51.09 N ATOM 2036 CD2 HIS A 142 56.364 40.511 39.527 1.00 48.91 C ATOM 2037 CE1 HIS A 142 57.955 39.741 40.837 1.00 53.65 C ATOM 2038 NE2 HIS A 142 56.875 40.506 40.801 1.00 55.06 N ATOM 2039 HA HIS A 142 56.256 37.397 37.744 1.00 0.00 H ATOM 2040 HB2 HIS A 142 58.088 38.884 37.058 1.00 0.00 H ATOM 2041 HB3 HIS A 142 56.918 40.185 36.734 1.00 0.00 H ATOM 2042 HD2 HIS A 142 55.482 41.049 39.178 1.00 0.00 H ATOM 2043 HE1 HIS A 142 58.571 39.553 41.716 1.00 0.00 H ATOM 2044 H HIS A 142 56.625 38.336 35.056 1.00 0.00 H ATOM 2045 N ASP A 143 54.146 39.749 36.751 1.00 18.95 N ATOM 2046 CA ASP A 143 52.860 40.390 36.946 1.00 18.24 C ATOM 2047 C ASP A 143 51.701 39.417 36.951 1.00 18.89 C ATOM 2048 O ASP A 143 50.779 39.589 37.759 1.00 20.23 O ATOM 2049 CB ASP A 143 52.617 41.446 35.863 1.00 24.25 C ATOM 2050 CG ASP A 143 53.433 42.703 36.066 1.00 25.96 C ATOM 2051 OD1 ASP A 143 54.113 42.836 37.098 1.00 28.15 O ATOM 2052 OD2 ASP A 143 53.391 43.572 35.171 1.00 34.87 O ATOM 2053 HA ASP A 143 52.904 40.855 37.931 1.00 0.00 H ATOM 2054 HB2 ASP A 143 52.876 41.017 34.895 1.00 0.00 H ATOM 2055 HB3 ASP A 143 51.560 41.713 35.870 1.00 0.00 H ATOM 2056 H ASP A 143 54.702 40.040 35.922 1.00 0.00 H ATOM 2057 N VAL A 144 51.692 38.396 36.110 1.00 14.39 N ATOM 2058 CA VAL A 144 50.609 37.423 36.093 1.00 17.62 C ATOM 2059 C VAL A 144 50.533 36.660 37.409 1.00 20.96 C ATOM 2060 O VAL A 144 49.467 36.380 37.966 1.00 22.17 O ATOM 2061 CB VAL A 144 50.799 36.474 34.889 1.00 17.17 C ATOM 2062 CG1 VAL A 144 49.903 35.272 34.996 1.00 23.96 C ATOM 2063 CG2 VAL A 144 50.462 37.229 33.604 1.00 19.83 C ATOM 2064 HA VAL A 144 49.658 37.943 35.981 1.00 0.00 H ATOM 2065 HB VAL A 144 51.834 36.134 34.878 1.00 0.00 H ATOM 2066 HG11 VAL A 144 50.137 34.726 35.910 1.00 0.00 H ATOM 2067 HG12 VAL A 144 48.863 35.597 35.022 1.00 0.00 H ATOM 2068 HG13 VAL A 144 50.061 34.625 34.134 1.00 0.00 H ATOM 2069 HG21 VAL A 144 49.427 37.570 33.645 1.00 0.00 H ATOM 2070 HG22 VAL A 144 51.125 38.088 33.504 1.00 0.00 H ATOM 2071 HG23 VAL A 144 50.594 36.566 32.749 1.00 0.00 H ATOM 2072 H VAL A 144 52.481 38.285 35.442 1.00 0.00 H ATOM 2073 N ARG A 145 51.679 36.280 37.969 1.00 20.64 N ATOM 2074 CA ARG A 145 51.757 35.548 39.218 1.00 21.72 C ATOM 2075 C ARG A 145 51.163 36.317 40.390 1.00 24.00 C ATOM 2076 O ARG A 145 50.508 35.776 41.276 1.00 25.92 O ATOM 2077 CB ARG A 145 53.235 35.302 39.554 1.00 22.05 C ATOM 2078 CG ARG A 145 53.793 34.100 38.835 1.00 20.61 C ATOM 2079 CD ARG A 145 55.109 33.673 39.446 1.00 29.26 C ATOM 2080 NE ARG A 145 56.295 34.419 39.122 1.00 32.88 N ATOM 2081 CZ ARG A 145 57.041 35.205 39.874 1.00 38.46 C ATOM 2082 NH1 ARG A 145 56.709 35.394 41.155 1.00 45.08 N ATOM 2083 NH2 ARG A 145 58.119 35.757 39.316 1.00 39.05 N ATOM 2084 HA ARG A 145 51.194 34.625 39.080 1.00 0.00 H ATOM 2085 HB2 ARG A 145 53.811 36.181 39.267 1.00 0.00 H ATOM 2086 HB3 ARG A 145 53.329 35.143 40.628 1.00 0.00 H ATOM 2087 HG2 ARG A 145 53.081 33.278 38.907 1.00 0.00 H ATOM 2088 HG3 ARG A 145 53.950 34.352 37.786 1.00 0.00 H ATOM 2089 HD2 ARG A 145 55.285 32.642 39.141 1.00 0.00 H ATOM 2090 HD3 ARG A 145 54.989 33.715 40.529 1.00 0.00 H ATOM 2091 HE ARG A 145 56.616 34.323 38.137 1.00 0.00 H ATOM 2092 HH12 ARG A 145 57.290 36.012 41.757 1.00 0.00 H ATOM 2093 HH11 ARG A 145 55.870 34.923 41.550 1.00 0.00 H ATOM 2094 HH22 ARG A 145 58.732 36.383 39.877 1.00 0.00 H ATOM 2095 HH21 ARG A 145 58.347 35.562 38.320 1.00 0.00 H ATOM 2096 H ARG A 145 52.567 36.521 37.484 1.00 0.00 H ATOM 2097 N GLY A 146 51.381 37.627 40.395 1.00 24.41 N ATOM 2098 CA GLY A 146 50.879 38.516 41.425 1.00 28.08 C ATOM 2099 C GLY A 146 49.412 38.831 41.197 1.00 31.87 C ATOM 2100 O GLY A 146 48.768 39.448 42.034 1.00 32.86 O ATOM 2101 HA3 GLY A 146 51.451 39.444 41.407 1.00 0.00 H ATOM 2102 HA2 GLY A 146 50.995 38.038 42.398 1.00 0.00 H ATOM 2103 H GLY A 146 51.941 38.037 39.620 1.00 0.00 H ATOM 2104 N ALA A 147 48.869 38.415 40.068 1.00 34.94 N ATOM 2105 CA ALA A 147 47.511 38.607 39.634 1.00 38.71 C ATOM 2106 C ALA A 147 46.593 37.428 39.921 1.00 41.16 C ATOM 2107 O ALA A 147 45.364 37.558 39.807 1.00 41.29 O ATOM 2108 CB ALA A 147 47.513 38.916 38.132 1.00 36.50 C ATOM 2109 HA ALA A 147 47.108 39.440 40.210 1.00 0.00 H ATOM 2110 HB1 ALA A 147 48.092 39.821 37.949 1.00 0.00 H ATOM 2111 HB2 ALA A 147 47.960 38.082 37.591 1.00 0.00 H ATOM 2112 HB3 ALA A 147 46.488 39.064 37.791 1.00 0.00 H ATOM 2113 H ALA A 147 49.492 37.891 39.421 1.00 0.00 H ATOM 2114 N ILE A 148 47.148 36.269 40.263 1.00 46.29 N ATOM 2115 CA ILE A 148 46.275 35.117 40.565 1.00 50.98 C ATOM 2116 C ILE A 148 46.284 34.960 42.085 1.00 56.95 C ATOM 2117 O ILE A 148 46.744 33.936 42.621 1.00 62.73 O ATOM 2118 CB ILE A 148 46.613 33.840 39.795 1.00 45.26 C ATOM 2119 CG1 ILE A 148 48.023 33.296 40.032 1.00 38.75 C ATOM 2120 CG2 ILE A 148 46.447 34.065 38.288 1.00 37.97 C ATOM 2121 CD1 ILE A 148 48.101 31.823 39.682 1.00 41.31 C ATOM 2122 HA ILE A 148 45.263 35.312 40.210 1.00 0.00 H ATOM 2123 OXT ILE A 148 45.856 35.911 42.789 1.00 63.18 O ATOM 2124 HB ILE A 148 45.912 33.099 40.179 1.00 0.00 H ATOM 2125 HG12 ILE A 148 48.728 33.848 39.411 1.00 0.00 H ATOM 2126 HG13 ILE A 148 48.285 33.428 41.082 1.00 0.00 H ATOM 2127 HD11 ILE A 148 47.401 31.265 40.304 1.00 0.00 H ATOM 2128 HD12 ILE A 148 47.844 31.686 38.632 1.00 0.00 H ATOM 2129 HD13 ILE A 148 49.114 31.462 39.860 1.00 0.00 H ATOM 2130 HG21 ILE A 148 45.416 34.346 38.075 1.00 0.00 H ATOM 2131 HG22 ILE A 148 47.116 34.863 37.965 1.00 0.00 H ATOM 2132 HG23 ILE A 148 46.692 33.146 37.756 1.00 0.00 H ATOM 2133 H ILE A 148 48.182 36.175 40.317 1.00 0.00 H TER 2134 ILE A 148 HETATM 2135 O HOH 1 49.774 37.576 17.804 1.00 6.89 O HETATM 2136 O HOH 2 50.565 29.787 10.616 1.00 11.87 O HETATM 2137 O HOH 3 45.338 38.481 28.435 1.00 12.89 O HETATM 2138 O HOH 4 67.611 37.951 25.171 1.00 13.08 O HETATM 2139 O HOH 5 52.632 25.486 16.949 1.00 13.26 O HETATM 2140 O HOH 6 42.007 32.354 11.495 1.00 15.30 O HETATM 2141 O HOH 7 56.904 32.049 44.515 1.00 18.49 O HETATM 2142 O HOH 8 47.225 42.786 9.607 1.00 14.01 O HETATM 2143 O HOH 9 57.104 39.055 16.180 1.00 16.50 O HETATM 2144 O HOH 10 36.795 36.436 18.803 1.00 14.98 O HETATM 2145 O HOH 11 66.346 41.351 25.457 1.00 19.80 O HETATM 2146 O HOH 12 67.749 37.987 18.724 1.00 21.55 O HETATM 2147 O HOH 13 53.056 25.087 43.039 1.00 18.83 O HETATM 2148 O HOH 14 61.316 42.723 20.099 1.00 22.26 O HETATM 2149 O HOH 15 58.725 44.510 13.754 1.00 26.19 O HETATM 2150 O HOH 16 45.780 28.379 8.053 1.00 28.13 O HETATM 2151 O HOH 17 48.465 44.979 6.991 1.00 26.70 O HETATM 2152 O HOH 18 61.837 28.662 19.231 1.00 27.30 O HETATM 2153 O HOH 19 32.303 40.070 21.467 1.00 19.10 O HETATM 2154 O HOH 20 41.367 29.102 37.263 1.00 28.15 O HETATM 2155 O HOH 21 64.613 32.923 27.851 1.00 24.25 O HETATM 2156 O HOH 22 51.714 39.696 2.852 1.00 32.28 O HETATM 2157 O HOH 23 62.871 25.915 36.508 1.00 31.03 O HETATM 2158 O HOH 24 41.370 46.135 7.021 1.00 30.91 O HETATM 2159 O HOH 25 44.101 36.347 5.025 1.00 25.55 O HETATM 2160 O HOH 26 52.743 26.463 10.631 1.00 27.31 O HETATM 2161 O HOH 27 55.322 25.246 17.148 1.00 25.22 O HETATM 2162 O HOH 28 53.820 19.734 23.025 1.00 29.90 O HETATM 2163 O HOH 29 59.145 24.358 39.788 1.00 32.18 O HETATM 2164 O HOH 30 57.821 44.339 21.671 1.00 33.10 O HETATM 2165 O HOH 31 62.805 32.737 31.729 1.00 27.62 O HETATM 2166 O HOH 32 39.720 42.011 22.489 1.00 34.58 O HETATM 2167 O HOH 33 57.867 35.459 10.822 1.00 39.96 O HETATM 2168 O HOH 34 41.371 42.919 24.031 1.00 42.12 O HETATM 2169 O HOH 35 60.739 33.398 38.998 1.00 26.31 O HETATM 2170 O HOH 36 48.166 21.284 13.241 1.00 38.60 O HETATM 2171 O HOH 37 63.572 33.267 37.708 1.00 34.98 O HETATM 2172 O HOH 38 60.277 35.100 12.016 1.00 41.27 O HETATM 2173 O HOH 39 53.780 40.461 4.380 1.00 35.29 O HETATM 2174 O HOH 40 62.369 32.050 16.076 1.00 36.67 O HETATM 2175 O HOH 41 43.054 44.754 5.238 1.00 42.51 O HETATM 2176 O HOH 42 44.514 43.161 26.342 1.00 30.49 O HETATM 2177 O HOH 43 46.211 44.231 33.365 1.00 41.57 O HETATM 2178 O HOH 44 58.929 35.932 36.493 1.00 43.78 O HETATM 2179 O HOH 45 65.669 35.944 15.825 1.00 31.29 O HETATM 2180 O HOH 46 54.450 39.103 41.564 1.00 47.33 O HETATM 2181 O HOH 47 46.667 44.301 19.722 1.00 39.68 O HETATM 2182 O HOH 48 56.178 21.060 30.342 1.00 51.05 O HETATM 2183 O HOH 49 40.645 34.757 11.326 1.00 29.69 O HETATM 2184 O HOH 50 57.091 43.965 24.333 1.00 39.73 O HETATM 2185 O HOH 51 51.884 44.180 25.570 1.00 29.49 O HETATM 2186 O HOH 52 49.080 26.165 44.936 1.00 35.18 O HETATM 2187 O HOH 53 34.805 26.750 27.764 1.00 37.28 O HETATM 2188 O HOH 54 50.298 41.992 39.266 1.00 42.22 O HETATM 2189 O HOH 55 51.046 33.225 42.323 1.00 35.83 O HETATM 2190 O HOH 56 42.788 43.820 16.368 1.00 33.92 O HETATM 2191 O HOH 57 61.251 26.641 29.550 1.00 39.77 O HETATM 2192 O HOH 58 57.739 26.388 16.586 1.00 41.36 O HETATM 2193 O HOH 59 42.175 17.647 26.430 1.00 37.27 O HETATM 2194 O HOH 60 53.459 44.800 6.284 1.00 45.61 O HETATM 2195 O HOH 61 63.118 36.778 37.860 1.00 43.83 O HETATM 2196 O HOH 62 55.849 43.485 30.262 1.00 48.52 O HETATM 2197 O HOH 63 54.094 22.230 15.671 1.00 40.83 O HETATM 2198 O HOH 64 33.779 23.658 28.653 1.00 41.15 O HETATM 2199 O HOH 65 44.154 24.648 11.042 1.00 46.54 O HETATM 2200 O HOH 66 34.430 37.469 31.444 1.00 42.90 O HETATM 2201 O HOH 67 64.835 42.718 27.171 1.00 41.93 O HETATM 2202 O HOH 68 45.060 17.189 24.664 1.00 36.44 O HETATM 2203 O HOH 69 65.191 30.062 20.608 1.00 49.60 O HETATM 2204 O HOH 70 57.092 22.667 36.733 1.00 43.51 O HETATM 2205 O HOH 71 46.243 23.812 42.619 1.00 46.37 O HETATM 2206 O HOH 72 32.619 24.815 20.016 1.00 46.79 O HETATM 2207 O HOH 73 46.939 22.709 8.762 1.00 48.16 O HETATM 2208 O HOH 74 59.767 25.092 32.701 1.00 56.78 O HETATM 2209 O HOH 75 56.463 22.499 42.278 1.00 47.64 O HETATM 2210 O HOH 76 58.751 34.607 8.324 1.00 58.18 O HETATM 2211 O HOH 77 45.729 22.845 12.253 1.00 45.40 O HETATM 2212 O HOH 78 44.897 23.112 18.365 1.00 54.18 O HETATM 2213 O HOH 79 37.517 39.380 32.750 1.00 57.37 O HETATM 2214 O HOH 80 39.687 33.286 8.245 1.00 55.94 O HETATM 2215 O HOH 81 70.838 27.773 39.476 1.00 61.83 O HETATM 2216 O HOH 82 65.992 48.171 21.789 1.00 48.99 O HETATM 2217 O HOH 83 55.784 23.459 7.698 1.00 65.20 O HETATM 2218 O HOH 84 54.986 25.001 13.498 1.00 60.29 O HETATM 2219 O HOH 85 30.673 39.090 26.263 1.00 45.83 O HETATM 2220 O HOH 86 40.157 18.812 19.719 1.00 51.61 O HETATM 2221 O HOH 87 37.808 17.837 21.940 1.00 59.66 O HETATM 2222 O HOH 88 50.604 44.204 28.204 1.00 57.59 O HETATM 2223 O HOH 89 51.694 44.248 4.466 1.00 64.97 O HETATM 2224 O HOH 90 68.204 32.015 20.845 1.00 55.34 O HETATM 2225 O HOH 91 56.137 38.434 3.478 1.00 64.29 O HETATM 2226 O HOH 92 46.983 47.551 15.025 1.00 67.80 O HETATM 2227 O HOH 93 39.869 48.409 8.406 1.00 59.78 O HETATM 2228 O HOH 94 41.893 42.248 28.774 1.00 52.22 O HETATM 2229 O HOH 95 63.734 29.770 26.157 1.00 56.23 O HETATM 2230 O HOH 96 32.974 26.466 30.364 1.00 64.88 O HETATM 2231 O HOH 97 61.584 45.483 21.055 1.00 64.73 O HETATM 2232 O HOH 98 62.366 33.321 10.584 1.00 57.20 O HETATM 2233 O HOH 99 59.494 53.570 4.790 1.00 61.66 O HETATM 2234 O HOH 100 58.486 35.473 5.851 1.00 67.10 O HETATM 2235 N1 FMN A 101 52.007 40.166 12.396 1.00 -0.25 N HETATM 2236 C2 FMN A 101 50.886 40.848 12.822 1.00 0.24 C HETATM 2237 O2 FMN A 101 50.862 41.509 13.993 1.00 -0.39 O HETATM 2238 N3 FMN A 101 49.748 40.933 12.051 1.00 -0.19 N HETATM 2239 C4 FMN A 101 49.662 40.301 10.809 1.00 0.27 C HETATM 2240 O4 FMN A 101 48.491 40.393 10.121 1.00 -0.37 O HETATM 2241 C4A FMN A 101 50.803 39.600 10.334 1.00 0.21 C HETATM 2242 N5 FMN A 101 50.726 38.953 9.108 1.00 -0.24 N HETATM 2243 C5A FMN A 101 51.887 38.374 8.596 1.00 0.09 C HETATM 2244 C6 FMN A 101 51.844 37.885 7.269 1.00 -0.04 C HETATM 2245 C7 FMN A 101 53.024 37.322 6.776 1.00 -0.04 C HETATM 2246 C7M FMN A 101 53.098 36.790 5.441 1.00 -0.04 C HETATM 2247 H3 FMN A 101 52.125 36.912 4.943 1.00 0.04 H HETATM 2248 H4 FMN A 101 53.355 35.721 5.486 1.00 0.04 H HETATM 2249 H5 FMN A 101 53.870 37.330 4.873 1.00 0.04 H HETATM 2250 C8 FMN A 101 54.161 37.266 7.585 1.00 -0.04 C HETATM 2251 C8M FMN A 101 55.384 36.717 7.122 1.00 -0.03 C HETATM 2252 H6 FMN A 101 56.138 36.776 7.921 1.00 0.04 H HETATM 2253 H7 FMN A 101 55.732 37.284 6.246 1.00 0.04 H HETATM 2254 H8 FMN A 101 55.230 35.665 6.840 1.00 0.04 H HETATM 2255 C9 FMN A 101 54.193 37.764 8.904 1.00 -0.03 C HETATM 2256 C9A FMN A 101 53.022 38.337 9.436 1.00 0.10 C HETATM 2257 N10 FMN A 101 53.076 38.841 10.744 1.00 -0.21 N HETATM 2258 C10 FMN A 101 51.950 39.550 11.153 1.00 0.19 C HETATM 2259 C1 FMN A 101 54.156 38.836 11.636 1.00 0.09 C HETATM 2260 C2 FMN A 101 54.219 37.502 12.432 1.00 0.11 C HETATM 2261 O2 FMN A 101 53.157 37.374 13.387 1.00 -0.39 O HETATM 2262 H13 FMN A 101 52.322 37.404 12.936 1.00 0.21 H HETATM 2263 C3 FMN A 101 55.540 37.486 13.239 1.00 0.11 C HETATM 2264 O3 FMN A 101 56.606 37.200 12.341 1.00 -0.39 O HETATM 2265 H15 FMN A 101 56.459 36.353 11.937 1.00 0.21 H HETATM 2266 C4 FMN A 101 55.611 36.545 14.377 1.00 0.11 C HETATM 2267 O4 FMN A 101 56.837 36.790 15.093 1.00 -0.39 O HETATM 2268 H17 FMN A 101 56.844 37.686 15.410 1.00 0.21 H HETATM 2269 C5 FMN A 101 55.542 35.175 13.990 1.00 0.11 C HETATM 2270 O5 FMN A 101 55.548 34.455 15.212 1.00 -0.27 O HETATM 2271 P FMN A 101 55.648 32.807 15.287 1.00 0.20 P HETATM 2272 O1P FMN A 101 54.451 32.120 14.378 1.00 -0.55 O HETATM 2273 O2P FMN A 101 55.376 32.326 16.882 1.00 -0.55 O HETATM 2274 O3P FMN A 101 57.163 32.379 14.862 1.00 -0.55 O HETATM 2275 H18 FMN A 101 56.412 34.901 13.374 1.00 0.06 H HETATM 2276 H19 FMN A 101 54.618 34.977 13.428 1.00 0.06 H HETATM 2277 H16 FMN A 101 54.761 36.750 15.045 1.00 0.06 H HETATM 2278 H14 FMN A 101 55.683 38.497 13.647 1.00 0.06 H HETATM 2279 H12 FMN A 101 54.186 36.657 11.728 1.00 0.06 H HETATM 2280 H10 FMN A 101 54.042 39.671 12.343 1.00 0.06 H HETATM 2281 H11 FMN A 101 55.090 38.961 11.069 1.00 0.06 H HETATM 2282 H9 FMN A 101 55.100 37.707 9.496 1.00 0.05 H HETATM 2283 H2 FMN A 101 50.944 37.944 6.667 1.00 0.06 H HETATM 2284 H1 FMN A 101 48.967 41.459 12.388 1.00 0.22 H CONECT 2235 2236 2258 CONECT 2236 2235 2237 2238 CONECT 2237 2236 CONECT 2238 2236 2239 2284 CONECT 2239 2238 2240 2241 CONECT 2240 2239 CONECT 2241 2239 2242 2258 CONECT 2242 2241 2243 CONECT 2243 2242 2244 2256 CONECT 2244 2243 2245 2283 CONECT 2245 2244 2246 2250 CONECT 2246 2245 2247 2248 2249 CONECT 2247 2246 CONECT 2248 2246 CONECT 2249 2246 CONECT 2250 2245 2251 2255 CONECT 2251 2250 2252 2253 2254 CONECT 2252 2251 CONECT 2253 2251 CONECT 2254 2251 CONECT 2255 2250 2256 2282 CONECT 2256 2243 2255 2257 CONECT 2257 2256 2258 2259 CONECT 2258 2235 2241 2257 CONECT 2259 2257 2260 2280 2281 CONECT 2260 2259 2261 2263 2279 CONECT 2261 2260 2262 CONECT 2262 2261 CONECT 2263 2260 2264 2266 2278 CONECT 2264 2263 2265 CONECT 2265 2264 CONECT 2266 2263 2267 2269 2277 CONECT 2267 2266 2268 CONECT 2268 2267 CONECT 2269 2266 2270 2275 2276 CONECT 2270 2269 2271 CONECT 2271 2270 2272 2273 2274 CONECT 2272 2271 CONECT 2273 2271 CONECT 2274 2271 CONECT 2275 2269 CONECT 2276 2269 CONECT 2277 2266 CONECT 2278 2263 CONECT 2279 2260 CONECT 2280 2259 CONECT 2281 2259 CONECT 2282 2255 CONECT 2283 2244 CONECT 2284 2238 MASTER 0 0 0 0 0 0 0 0 2283 1 50 12 END
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Related entries of code: 1akq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1akr
RCSB PDB
PDBbind
147aa, >1AKR_1|Chain... at 98%
1akt
RCSB PDB
PDBbind
147aa, >1AKT_1|Chain... at 98%
1aku
RCSB PDB
PDBbind
147aa, >1AKU_1|Chain... at 100%
1akv
RCSB PDB
PDBbind
147aa, >1AKV_1|Chain... at 100%
1akw
RCSB PDB
PDBbind
147aa, >1AKW_1|Chain... at 98%
1azl
RCSB PDB
PDBbind
147aa, >1AZL_1|Chain... at 98%
1c7e
RCSB PDB
PDBbind
147aa, >1C7E_1|Chains... at 99%
1c7f
RCSB PDB
PDBbind
147aa, >1C7F_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1akr
RCSB PDB
PDBbind
FMN ox
1akt
RCSB PDB
PDBbind
FMN ox
1akw
RCSB PDB
PDBbind
FMN ox
1azl
RCSB PDB
PDBbind
FMN ox
1c7f
RCSB PDB
PDBbind
FMN ox
1czk
RCSB PDB
PDBbind
FMN ox
1czr
RCSB PDB
PDBbind
FMN ox
Entry Information
PDB ID
1akq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
flavodoxin
Ligand Name
FMN ox
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=0.79nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Eur.J.Biochem. v258 pp. 362-71, 1998
Ligand Properties
Formula
C
1
7
H
2
2
N
4
O
9
P
Molecular Weight
457.352
Exact Mass
457.112
No. of atoms
53
No. of bonds
55
Polar Surface Area
224.84
LOGP Value
-2.56 (
Computed with XLOGP3
)
-2.00 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 3
Canonical SMILES
O=c1[nH]c(=O)c2c(n1)n(C[C@@H]([C@@H]([C@@H](COP(O)(O)O)O)O)O)c1c(n2)cc(c(c1)C)C
InChI String
InChI=1S/C17H23N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24,27-29,31H,5-6H2,1-2H3,(H,20,25,26)/t11-,12+,14-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00323
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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