Browse entries in the PDBbind-CN Database
HEADER 3BRN_COMPLEX COMPND 3BRN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 ALA GLN CYS ASP PHE GLY GLY PRO PHE GLN ALA TYR LYS SEQRES 2 A 153 SER VAL ASN GLY PRO GLY ASN GLY GLY TYR TYR LEU ARG SEQRES 3 A 153 LYS THR THR LYS PRO GLY THR PRO GLU CYS ALA TYR VAL SEQRES 4 A 153 LEU VAL PRO GLN ASN THR LEU SER GLU GLY GLN SER THR SEQRES 5 A 153 SER PHE THR TYR GLY LYS LEU GLN ASN GLY GLN MET ILE SEQRES 6 A 153 GLN LEU THR ALA THR VAL THR VAL ASN GLY ASP LYS ILE SEQRES 7 A 153 GLU VAL THR GLY ALA GLY GLN ASP LEU SER GLY THR THR SEQRES 8 A 153 THR VAL LEU PHE SER ASP TYR ARG SER CYS ASP VAL MET SEQRES 9 A 153 ARG GLY PRO ASP GLY ASN TYR GLU LEU TRP VAL HIS SER SEQRES 10 A 153 SER ALA ILE ASN LEU GLN SER TYR GLY CYS CYS ASP THR SEQRES 11 A 153 LYS PHE ALA GLN VAL ALA GLY GLY ARG PRO ILE HIS HIS SEQRES 12 A 153 THR TRP GLN THR TYR CYS PRO PRO LEU PRO HET SRO A 204 26 SSBOND 1 CYS A 7 CYS A 131 SSBOND 2 CYS A 105 CYS A 132 SSBOND 3 CYS A 40 CYS A 153 ATOM 1 N ALA A 5 -30.388 49.439 -16.350 1.00 52.84 N ATOM 2 CA ALA A 5 -30.952 48.915 -15.063 1.00 59.00 C ATOM 3 C ALA A 5 -29.918 48.986 -13.937 1.00 57.08 C ATOM 4 O ALA A 5 -28.718 48.791 -14.165 1.00 55.04 O ATOM 5 CB ALA A 5 -31.475 47.482 -15.234 1.00 56.46 C ATOM 6 HA ALA A 5 -31.793 49.551 -14.786 1.00 0.00 H ATOM 7 HB1 ALA A 5 -32.260 47.471 -15.990 1.00 0.00 H ATOM 8 HB2 ALA A 5 -30.657 46.833 -15.548 1.00 0.00 H ATOM 9 HB3 ALA A 5 -31.878 47.128 -14.285 1.00 0.00 H ATOM 10 HN3 ALA A 5 -29.561 48.870 -16.622 1.00 0.00 H ATOM 11 HN2 ALA A 5 -30.102 50.431 -16.223 1.00 0.00 H ATOM 12 HN1 ALA A 5 -31.112 49.378 -17.094 1.00 0.00 H ATOM 13 N GLN A 6 -30.393 49.267 -12.724 1.00 50.46 N ATOM 14 CA GLN A 6 -29.513 49.468 -11.577 1.00 47.33 C ATOM 15 C GLN A 6 -28.642 48.258 -11.275 1.00 41.60 C ATOM 16 O GLN A 6 -29.075 47.111 -11.416 1.00 39.81 O ATOM 17 CB GLN A 6 -30.315 49.859 -10.332 1.00 43.68 C ATOM 18 CG GLN A 6 -30.669 51.328 -10.247 1.00 38.94 C ATOM 19 CD GLN A 6 -31.386 51.661 -8.955 1.00 41.40 C ATOM 20 OE1 GLN A 6 -32.256 50.758 -8.518 1.00 35.84 O ATOM 21 NE2 GLN A 6 -31.124 52.687 -8.327 1.00 42.04 N ATOM 22 HA GLN A 6 -28.845 50.285 -11.849 1.00 0.00 H ATOM 23 HB2 GLN A 6 -31.242 49.285 -10.330 1.00 0.00 H ATOM 24 HB3 GLN A 6 -29.726 49.599 -9.452 1.00 0.00 H ATOM 25 HG2 GLN A 6 -29.753 51.916 -10.304 1.00 0.00 H ATOM 26 HG3 GLN A 6 -31.316 51.584 -11.086 1.00 0.00 H ATOM 27 HE22 GLN A 6 -30.436 53.368 -8.707 1.00 0.00 H ATOM 28 HE21 GLN A 6 -31.591 52.873 -7.417 1.00 0.00 H ATOM 29 H GLN A 6 -31.421 49.345 -12.591 1.00 0.00 H ATOM 30 N CYS A 7 -27.406 48.528 -10.863 1.00 38.53 N ATOM 31 CA CYS A 7 -26.473 47.481 -10.451 1.00 42.51 C ATOM 32 C CYS A 7 -26.726 47.186 -8.980 1.00 42.04 C ATOM 33 O CYS A 7 -27.143 48.072 -8.233 1.00 40.13 O ATOM 34 CB CYS A 7 -25.021 47.963 -10.626 1.00 45.35 C ATOM 35 SG CYS A 7 -24.602 48.515 -12.307 1.00 51.76 S ATOM 36 HA CYS A 7 -26.621 46.590 -11.061 1.00 0.00 H ATOM 37 HB2 CYS A 7 -24.356 47.141 -10.362 1.00 0.00 H ATOM 38 HB3 CYS A 7 -24.855 48.796 -9.943 1.00 0.00 H ATOM 39 H CYS A 7 -27.093 49.519 -10.833 1.00 0.00 H ATOM 40 N ASP A 8 -26.420 45.966 -8.551 1.00 36.85 N ATOM 41 CA ASP A 8 -26.570 45.616 -7.149 1.00 38.79 C ATOM 42 C ASP A 8 -25.224 45.293 -6.526 1.00 35.98 C ATOM 43 O ASP A 8 -24.726 44.182 -6.659 1.00 34.83 O ATOM 44 CB ASP A 8 -27.521 44.431 -6.984 1.00 41.80 C ATOM 45 CG ASP A 8 -28.134 44.364 -5.596 1.00 51.14 C ATOM 46 OD1 ASP A 8 -27.422 44.648 -4.607 1.00 47.61 O ATOM 47 OD2 ASP A 8 -29.338 44.036 -5.498 1.00 55.99 O ATOM 48 HA ASP A 8 -26.994 46.478 -6.634 1.00 0.00 H ATOM 49 HB2 ASP A 8 -28.323 44.522 -7.716 1.00 0.00 H ATOM 50 HB3 ASP A 8 -26.967 43.510 -7.166 1.00 0.00 H ATOM 51 H ASP A 8 -26.070 45.255 -9.225 1.00 0.00 H ATOM 52 N PHE A 9 -24.649 46.261 -5.820 1.00 36.01 N ATOM 53 CA PHE A 9 -23.310 46.108 -5.257 1.00 32.02 C ATOM 54 C PHE A 9 -23.337 45.638 -3.803 1.00 37.54 C ATOM 55 O PHE A 9 -22.324 45.694 -3.106 1.00 35.43 O ATOM 56 CB PHE A 9 -22.528 47.418 -5.371 1.00 35.12 C ATOM 57 CG PHE A 9 -22.329 47.884 -6.785 1.00 33.69 C ATOM 58 CD1 PHE A 9 -22.393 46.989 -7.839 1.00 30.59 C ATOM 59 CD2 PHE A 9 -22.076 49.218 -7.060 1.00 35.95 C ATOM 60 CE1 PHE A 9 -22.210 47.414 -9.141 1.00 37.59 C ATOM 61 CE2 PHE A 9 -21.892 49.649 -8.360 1.00 30.32 C ATOM 62 CZ PHE A 9 -21.959 48.746 -9.402 1.00 29.53 C ATOM 63 HA PHE A 9 -22.809 45.334 -5.839 1.00 0.00 H ATOM 64 HB2 PHE A 9 -23.071 48.191 -4.827 1.00 0.00 H ATOM 65 HB3 PHE A 9 -21.548 47.275 -4.915 1.00 0.00 H ATOM 66 HD2 PHE A 9 -22.021 49.936 -6.242 1.00 0.00 H ATOM 67 HE2 PHE A 9 -21.694 50.702 -8.563 1.00 0.00 H ATOM 68 HZ PHE A 9 -21.814 49.084 -10.428 1.00 0.00 H ATOM 69 HE1 PHE A 9 -22.264 46.698 -9.961 1.00 0.00 H ATOM 70 HD1 PHE A 9 -22.590 45.936 -7.639 1.00 0.00 H ATOM 71 H PHE A 9 -25.166 47.150 -5.664 1.00 0.00 H ATOM 72 N GLY A 10 -24.499 45.176 -3.352 1.00 40.64 N ATOM 73 CA GLY A 10 -24.601 44.419 -2.115 1.00 45.76 C ATOM 74 C GLY A 10 -24.295 42.968 -2.416 1.00 44.85 C ATOM 75 O GLY A 10 -24.664 42.449 -3.472 1.00 46.07 O ATOM 76 HA3 GLY A 10 -25.610 44.507 -1.712 1.00 0.00 H ATOM 77 HA2 GLY A 10 -23.886 44.803 -1.388 1.00 0.00 H ATOM 78 H GLY A 10 -25.362 45.362 -3.901 1.00 0.00 H ATOM 79 N GLY A 11 -23.516 42.337 -1.556 1.00 47.07 N ATOM 80 CA GLY A 11 -23.177 40.943 -1.790 1.00 49.08 C ATOM 81 C GLY A 11 -24.100 40.010 -1.028 1.00 49.45 C ATOM 82 O GLY A 11 -25.310 40.223 -0.977 1.00 40.17 O ATOM 83 HA3 GLY A 11 -22.151 40.769 -1.466 1.00 0.00 H ATOM 84 HA2 GLY A 11 -23.261 40.732 -2.856 1.00 0.00 H ATOM 85 H GLY A 11 -23.149 42.833 -0.719 1.00 0.00 H ATOM 86 N PRO A 12 -23.511 38.983 -0.405 1.00 48.77 N ATOM 87 CA PRO A 12 -22.070 38.839 -0.564 1.00 43.91 C ATOM 88 C PRO A 12 -21.700 38.316 -1.945 1.00 39.18 C ATOM 89 O PRO A 12 -22.571 37.944 -2.731 1.00 35.07 O ATOM 90 CB PRO A 12 -21.695 37.816 0.510 1.00 46.87 C ATOM 91 CG PRO A 12 -22.967 37.060 0.776 1.00 47.56 C ATOM 92 CD PRO A 12 -24.070 38.050 0.589 1.00 49.68 C ATOM 93 HA PRO A 12 -21.548 39.791 -0.464 1.00 0.00 H ATOM 94 HD3 PRO A 12 -24.971 37.567 0.211 1.00 0.00 H ATOM 95 HD2 PRO A 12 -24.299 38.563 1.523 1.00 0.00 H ATOM 96 HG3 PRO A 12 -22.973 36.671 1.794 1.00 0.00 H ATOM 97 HG2 PRO A 12 -23.073 36.234 0.073 1.00 0.00 H ATOM 98 HB2 PRO A 12 -20.917 37.145 0.147 1.00 0.00 H ATOM 99 HB3 PRO A 12 -21.348 38.317 1.414 1.00 0.00 H ATOM 100 N PHE A 13 -20.402 38.300 -2.230 1.00 36.90 N ATOM 101 CA PHE A 13 -19.896 37.796 -3.499 1.00 37.56 C ATOM 102 C PHE A 13 -19.050 36.545 -3.291 1.00 35.46 C ATOM 103 O PHE A 13 -18.136 36.530 -2.465 1.00 37.79 O ATOM 104 CB PHE A 13 -19.079 38.872 -4.216 1.00 30.12 C ATOM 105 CG PHE A 13 -19.894 40.047 -4.675 1.00 35.70 C ATOM 106 CD1 PHE A 13 -20.619 39.986 -5.853 1.00 32.20 C ATOM 107 CD2 PHE A 13 -19.936 41.212 -3.928 1.00 28.42 C ATOM 108 CE1 PHE A 13 -21.370 41.066 -6.278 1.00 34.25 C ATOM 109 CE2 PHE A 13 -20.685 42.295 -4.348 1.00 27.44 C ATOM 110 CZ PHE A 13 -21.403 42.221 -5.525 1.00 28.97 C ATOM 111 HA PHE A 13 -20.751 37.532 -4.121 1.00 0.00 H ATOM 112 HB2 PHE A 13 -18.310 39.233 -3.533 1.00 0.00 H ATOM 113 HB3 PHE A 13 -18.605 38.420 -5.088 1.00 0.00 H ATOM 114 HD2 PHE A 13 -19.372 41.276 -2.998 1.00 0.00 H ATOM 115 HE2 PHE A 13 -20.709 43.206 -3.751 1.00 0.00 H ATOM 116 HZ PHE A 13 -21.995 43.074 -5.858 1.00 0.00 H ATOM 117 HE1 PHE A 13 -21.936 41.005 -7.208 1.00 0.00 H ATOM 118 HD1 PHE A 13 -20.597 39.076 -6.452 1.00 0.00 H ATOM 119 H PHE A 13 -19.727 38.659 -1.525 1.00 0.00 H ATOM 120 N GLN A 14 -19.363 35.500 -4.047 1.00 32.62 N ATOM 121 CA GLN A 14 -18.796 34.174 -3.817 1.00 31.26 C ATOM 122 C GLN A 14 -17.650 33.890 -4.788 1.00 37.25 C ATOM 123 O GLN A 14 -17.868 33.812 -5.997 1.00 33.21 O ATOM 124 CB GLN A 14 -19.883 33.106 -3.953 1.00 37.84 C ATOM 125 CG GLN A 14 -21.034 33.296 -2.985 1.00 40.94 C ATOM 126 CD GLN A 14 -22.198 32.377 -3.282 1.00 56.17 C ATOM 127 OE1 GLN A 14 -23.008 32.655 -4.168 1.00 63.10 O ATOM 128 NE2 GLN A 14 -22.317 31.298 -2.509 1.00 41.66 N ATOM 129 HA GLN A 14 -18.395 34.146 -2.804 1.00 0.00 H ATOM 130 HB2 GLN A 14 -20.276 33.139 -4.969 1.00 0.00 H ATOM 131 HB3 GLN A 14 -19.434 32.130 -3.770 1.00 0.00 H ATOM 132 HG2 GLN A 14 -20.678 33.095 -1.975 1.00 0.00 H ATOM 133 HG3 GLN A 14 -21.378 34.328 -3.049 1.00 0.00 H ATOM 134 HE22 GLN A 14 -21.608 31.104 -1.773 1.00 0.00 H ATOM 135 HE21 GLN A 14 -23.119 30.649 -2.641 1.00 0.00 H ATOM 136 H GLN A 14 -20.035 35.630 -4.830 1.00 0.00 H ATOM 137 N ALA A 15 -16.435 33.792 -4.244 1.00 27.00 N ATOM 138 CA ALA A 15 -15.235 33.491 -5.000 1.00 32.35 C ATOM 139 C ALA A 15 -15.280 32.275 -5.931 1.00 33.44 C ATOM 140 O ALA A 15 -14.798 32.351 -7.052 1.00 34.52 O ATOM 141 CB ALA A 15 -14.021 33.439 -4.078 1.00 36.88 C ATOM 142 HA ALA A 15 -15.153 34.325 -5.697 1.00 0.00 H ATOM 143 HB1 ALA A 15 -13.898 34.404 -3.587 1.00 0.00 H ATOM 144 HB2 ALA A 15 -14.170 32.664 -3.326 1.00 0.00 H ATOM 145 HB3 ALA A 15 -13.131 33.212 -4.664 1.00 0.00 H ATOM 146 H ALA A 15 -16.344 33.940 -3.219 1.00 0.00 H ATOM 147 N TYR A 16 -15.801 31.138 -5.481 1.00 32.80 N ATOM 148 CA TYR A 16 -15.861 30.000 -6.390 1.00 35.19 C ATOM 149 C TYR A 16 -16.716 30.304 -7.634 1.00 35.46 C ATOM 150 O TYR A 16 -16.330 29.959 -8.742 1.00 38.24 O ATOM 151 CB TYR A 16 -16.303 28.705 -5.681 1.00 33.99 C ATOM 152 CG TYR A 16 -17.779 28.579 -5.481 1.00 28.57 C ATOM 153 CD1 TYR A 16 -18.383 29.066 -4.329 1.00 33.58 C ATOM 154 CD2 TYR A 16 -18.558 27.841 -6.366 1.00 36.74 C ATOM 155 CE1 TYR A 16 -19.726 28.890 -4.106 1.00 45.78 C ATOM 156 CE2 TYR A 16 -19.906 27.670 -6.153 1.00 35.50 C ATOM 157 CZ TYR A 16 -20.484 28.200 -5.021 1.00 39.01 C ATOM 158 OH TYR A 16 -21.834 28.084 -4.812 1.00 43.31 O ATOM 159 HA TYR A 16 -14.844 29.825 -6.740 1.00 0.00 H ATOM 160 HB3 TYR A 16 -15.823 28.671 -4.703 1.00 0.00 H ATOM 161 HB2 TYR A 16 -15.967 27.858 -6.279 1.00 0.00 H ATOM 162 HD2 TYR A 16 -18.093 27.391 -7.243 1.00 0.00 H ATOM 163 HE2 TYR A 16 -20.511 27.120 -6.874 1.00 0.00 H ATOM 164 HE1 TYR A 16 -20.189 29.296 -3.207 1.00 0.00 H ATOM 165 HD1 TYR A 16 -17.781 29.596 -3.591 1.00 0.00 H ATOM 166 HH TYR A 16 -22.073 28.519 -3.955 1.00 0.00 H ATOM 167 H TYR A 16 -16.156 31.062 -4.507 1.00 0.00 H ATOM 168 N LYS A 17 -17.811 31.044 -7.464 1.00 31.91 N ATOM 169 CA LYS A 17 -18.629 31.455 -8.604 1.00 32.76 C ATOM 170 C LYS A 17 -17.916 32.454 -9.515 1.00 33.14 C ATOM 171 O LYS A 17 -18.078 32.420 -10.731 1.00 32.31 O ATOM 172 CB LYS A 17 -19.973 32.023 -8.140 1.00 32.48 C ATOM 173 CG LYS A 17 -20.982 30.969 -7.728 1.00 32.38 C ATOM 174 CD LYS A 17 -21.875 31.474 -6.627 1.00 31.75 C ATOM 175 CE LYS A 17 -23.066 30.564 -6.423 1.00 50.98 C ATOM 176 NZ LYS A 17 -24.198 30.959 -7.298 1.00 60.38 N ATOM 177 HA LYS A 17 -18.808 30.555 -9.193 1.00 0.00 H ATOM 178 HB2 LYS A 17 -19.792 32.676 -7.286 1.00 0.00 H ATOM 179 HB3 LYS A 17 -20.400 32.605 -8.957 1.00 0.00 H ATOM 180 HG2 LYS A 17 -21.594 30.706 -8.591 1.00 0.00 H ATOM 181 HG3 LYS A 17 -20.450 30.084 -7.378 1.00 0.00 H ATOM 182 HD2 LYS A 17 -21.303 31.524 -5.700 1.00 0.00 H ATOM 183 HD3 LYS A 17 -22.230 32.471 -6.887 1.00 0.00 H ATOM 184 HE2 LYS A 17 -23.384 30.621 -5.382 1.00 0.00 H ATOM 185 HE3 LYS A 17 -22.776 29.540 -6.657 1.00 0.00 H ATOM 186 HZ1 LYS A 17 -24.482 31.934 -7.076 1.00 0.00 H ATOM 187 HZ2 LYS A 17 -23.902 30.901 -8.293 1.00 0.00 H ATOM 188 HZ3 LYS A 17 -25.000 30.317 -7.136 1.00 0.00 H ATOM 189 H LYS A 17 -18.088 31.334 -6.505 1.00 0.00 H ATOM 190 N SER A 18 -17.165 33.380 -8.931 1.00 31.91 N ATOM 191 CA SER A 18 -16.363 34.290 -9.724 1.00 31.15 C ATOM 192 C SER A 18 -15.299 33.528 -10.543 1.00 29.93 C ATOM 193 O SER A 18 -15.103 33.783 -11.733 1.00 34.70 O ATOM 194 CB SER A 18 -15.680 35.330 -8.816 1.00 23.26 C ATOM 195 OG SER A 18 -14.764 36.100 -9.576 1.00 36.87 O ATOM 196 HA SER A 18 -17.028 34.802 -10.420 1.00 0.00 H ATOM 197 HB2 SER A 18 -15.146 34.818 -8.016 1.00 0.00 H ATOM 198 HB3 SER A 18 -16.436 35.987 -8.385 1.00 0.00 H ATOM 199 HG SER A 18 -15.249 36.566 -10.302 1.00 0.00 H ATOM 200 H SER A 18 -17.152 33.453 -7.894 1.00 0.00 H ATOM 201 N VAL A 19 -14.566 32.646 -9.882 1.00 27.64 N ATOM 202 CA VAL A 19 -13.474 31.918 -10.521 1.00 32.11 C ATOM 203 C VAL A 19 -13.986 30.936 -11.590 1.00 35.90 C ATOM 204 O VAL A 19 -13.354 30.752 -12.627 1.00 34.02 O ATOM 205 CB VAL A 19 -12.633 31.164 -9.471 1.00 36.30 C ATOM 206 CG1 VAL A 19 -11.618 30.227 -10.138 1.00 30.30 C ATOM 207 CG2 VAL A 19 -11.971 32.151 -8.505 1.00 28.79 C ATOM 208 HA VAL A 19 -12.845 32.656 -11.019 1.00 0.00 H ATOM 209 HB VAL A 19 -13.298 30.531 -8.883 1.00 0.00 H ATOM 210 HG11 VAL A 19 -12.147 29.496 -10.749 1.00 0.00 H ATOM 211 HG12 VAL A 19 -10.946 30.810 -10.767 1.00 0.00 H ATOM 212 HG13 VAL A 19 -11.042 29.711 -9.370 1.00 0.00 H ATOM 213 HG21 VAL A 19 -11.321 32.824 -9.064 1.00 0.00 H ATOM 214 HG22 VAL A 19 -12.741 32.729 -7.994 1.00 0.00 H ATOM 215 HG23 VAL A 19 -11.382 31.600 -7.772 1.00 0.00 H ATOM 216 H VAL A 19 -14.774 32.467 -8.879 1.00 0.00 H ATOM 217 N ASN A 20 -15.131 30.322 -11.387 1.00 39.66 N ATOM 218 CA ASN A 20 -15.739 29.538 -12.438 1.00 37.34 C ATOM 219 C ASN A 20 -16.311 30.342 -13.560 1.00 38.11 C ATOM 220 O ASN A 20 -16.293 29.923 -14.665 1.00 41.76 O ATOM 221 CB ASN A 20 -16.851 28.689 -11.878 1.00 39.81 C ATOM 222 CG ASN A 20 -16.369 27.588 -11.038 1.00 35.10 C ATOM 223 OD1 ASN A 20 -15.316 27.061 -11.221 1.00 46.17 O ATOM 224 ND2 ASN A 20 -17.181 27.207 -10.116 1.00 27.63 N ATOM 225 HA ASN A 20 -14.925 28.937 -12.843 1.00 0.00 H ATOM 226 HB2 ASN A 20 -17.503 29.323 -11.278 1.00 0.00 H ATOM 227 HB3 ASN A 20 -17.419 28.269 -12.708 1.00 0.00 H ATOM 228 HD22 ASN A 20 -18.091 27.695 -9.990 1.00 0.00 H ATOM 229 HD21 ASN A 20 -16.928 26.411 -9.496 1.00 0.00 H ATOM 230 H ASN A 20 -15.603 30.401 -10.463 1.00 0.00 H ATOM 231 N GLY A 21 -16.884 31.478 -13.253 1.00 33.23 N ATOM 232 CA GLY A 21 -17.422 32.373 -14.263 1.00 37.25 C ATOM 233 C GLY A 21 -18.483 31.706 -15.119 1.00 45.62 C ATOM 234 O GLY A 21 -19.211 30.838 -14.640 1.00 44.50 O ATOM 235 HA3 GLY A 21 -16.608 32.704 -14.908 1.00 0.00 H ATOM 236 HA2 GLY A 21 -17.864 33.237 -13.766 1.00 0.00 H ATOM 237 H GLY A 21 -16.957 31.749 -12.252 1.00 0.00 H ATOM 238 N PRO A 22 -18.460 31.980 -16.432 1.00 46.61 N ATOM 239 CA PRO A 22 -19.492 31.469 -17.327 1.00 49.46 C ATOM 240 C PRO A 22 -19.372 29.962 -17.507 1.00 49.38 C ATOM 241 O PRO A 22 -20.247 29.339 -18.112 1.00 55.99 O ATOM 242 CB PRO A 22 -19.177 32.176 -18.643 1.00 48.97 C ATOM 243 CG PRO A 22 -17.691 32.319 -18.621 1.00 48.44 C ATOM 244 CD PRO A 22 -17.326 32.564 -17.172 1.00 40.67 C ATOM 245 HA PRO A 22 -20.501 31.648 -16.955 1.00 0.00 H ATOM 246 HD3 PRO A 22 -16.392 32.064 -16.914 1.00 0.00 H ATOM 247 HD2 PRO A 22 -17.234 33.631 -16.967 1.00 0.00 H ATOM 248 HG3 PRO A 22 -17.380 33.161 -19.239 1.00 0.00 H ATOM 249 HG2 PRO A 22 -17.215 31.408 -18.985 1.00 0.00 H ATOM 250 HB2 PRO A 22 -19.497 31.575 -19.494 1.00 0.00 H ATOM 251 HB3 PRO A 22 -19.661 33.152 -18.686 1.00 0.00 H ATOM 252 N GLY A 23 -18.278 29.388 -17.018 1.00 49.95 N ATOM 253 CA GLY A 23 -18.033 27.955 -17.158 1.00 49.69 C ATOM 254 C GLY A 23 -17.201 27.585 -18.376 1.00 52.15 C ATOM 255 O GLY A 23 -17.202 26.433 -18.816 1.00 48.37 O ATOM 256 HA3 GLY A 23 -18.995 27.448 -17.233 1.00 0.00 H ATOM 257 HA2 GLY A 23 -17.510 27.608 -16.267 1.00 0.00 H ATOM 258 H GLY A 23 -17.577 29.975 -16.522 1.00 0.00 H ATOM 259 N ASN A 24 -16.474 28.561 -18.910 1.00 49.67 N ATOM 260 CA ASN A 24 -15.627 28.356 -20.085 1.00 51.25 C ATOM 261 C ASN A 24 -14.686 29.548 -20.252 1.00 49.13 C ATOM 262 O ASN A 24 -14.844 30.561 -19.565 1.00 45.92 O ATOM 263 CB ASN A 24 -16.488 28.198 -21.346 1.00 46.70 C ATOM 264 CG ASN A 24 -17.185 29.489 -21.747 1.00 49.96 C ATOM 265 OD1 ASN A 24 -16.587 30.364 -22.370 1.00 50.81 O ATOM 266 ND2 ASN A 24 -18.478 29.571 -21.471 1.00 54.89 N ATOM 267 HA ASN A 24 -15.044 27.446 -19.943 1.00 0.00 H ATOM 268 HB2 ASN A 24 -15.848 27.877 -22.168 1.00 0.00 H ATOM 269 HB3 ASN A 24 -17.245 27.436 -21.158 1.00 0.00 H ATOM 270 HD22 ASN A 24 -18.946 28.808 -20.941 1.00 0.00 H ATOM 271 HD21 ASN A 24 -19.025 30.398 -21.784 1.00 0.00 H ATOM 272 H ASN A 24 -16.509 29.506 -18.476 1.00 0.00 H ATOM 273 N GLY A 25 -13.671 29.386 -21.100 1.00 39.71 N ATOM 274 CA GLY A 25 -12.763 30.479 -21.454 1.00 40.17 C ATOM 275 C GLY A 25 -11.879 30.990 -20.326 1.00 37.98 C ATOM 276 O GLY A 25 -11.269 30.204 -19.571 1.00 36.28 O ATOM 277 HA3 GLY A 25 -13.366 31.313 -21.813 1.00 0.00 H ATOM 278 HA2 GLY A 25 -12.114 30.130 -22.257 1.00 0.00 H ATOM 279 H GLY A 25 -13.518 28.450 -21.526 1.00 0.00 H ATOM 280 N GLY A 26 -11.749 32.314 -20.262 1.00 33.86 N ATOM 281 CA GLY A 26 -10.886 32.950 -19.276 1.00 31.90 C ATOM 282 C GLY A 26 -11.105 34.444 -19.188 1.00 35.88 C ATOM 283 O GLY A 26 -12.021 34.978 -19.813 1.00 31.79 O ATOM 284 HA3 GLY A 26 -9.847 32.765 -19.550 1.00 0.00 H ATOM 285 HA2 GLY A 26 -11.087 32.509 -18.300 1.00 0.00 H ATOM 286 H GLY A 26 -12.277 32.908 -20.933 1.00 0.00 H ATOM 287 N TYR A 27 -10.279 35.098 -18.369 1.00 35.22 N ATOM 288 CA TYR A 27 -10.423 36.514 -18.044 1.00 32.39 C ATOM 289 C TYR A 27 -9.112 37.268 -18.292 1.00 35.43 C ATOM 290 O TYR A 27 -8.040 36.826 -17.865 1.00 34.19 O ATOM 291 CB TYR A 27 -10.845 36.682 -16.574 1.00 27.98 C ATOM 292 CG TYR A 27 -12.288 36.315 -16.295 1.00 32.70 C ATOM 293 CD1 TYR A 27 -13.252 37.295 -16.101 1.00 27.35 C ATOM 294 CD2 TYR A 27 -12.660 34.989 -16.127 1.00 35.12 C ATOM 295 CE1 TYR A 27 -14.583 36.956 -15.845 1.00 26.96 C ATOM 296 CE2 TYR A 27 -13.956 34.641 -15.857 1.00 33.36 C ATOM 297 CZ TYR A 27 -14.909 35.620 -15.693 1.00 36.03 C ATOM 298 OH TYR A 27 -16.209 35.238 -15.492 1.00 32.88 O ATOM 299 HA TYR A 27 -11.194 36.932 -18.691 1.00 0.00 H ATOM 300 HB3 TYR A 27 -10.697 37.725 -16.293 1.00 0.00 H ATOM 301 HB2 TYR A 27 -10.206 36.047 -15.960 1.00 0.00 H ATOM 302 HD2 TYR A 27 -11.904 34.208 -16.212 1.00 0.00 H ATOM 303 HE2 TYR A 27 -14.233 33.590 -15.772 1.00 0.00 H ATOM 304 HE1 TYR A 27 -15.349 37.728 -15.767 1.00 0.00 H ATOM 305 HD1 TYR A 27 -12.966 38.346 -16.149 1.00 0.00 H ATOM 306 HH TYR A 27 -16.776 36.043 -15.391 1.00 0.00 H ATOM 307 H TYR A 27 -9.492 34.571 -17.940 1.00 0.00 H ATOM 308 N TYR A 28 -9.206 38.398 -18.995 1.00 29.43 N ATOM 309 CA TYR A 28 -8.076 39.291 -19.152 1.00 32.86 C ATOM 310 C TYR A 28 -8.105 40.276 -18.008 1.00 31.75 C ATOM 311 O TYR A 28 -9.181 40.750 -17.657 1.00 30.38 O ATOM 312 CB TYR A 28 -8.206 40.111 -20.428 1.00 28.44 C ATOM 313 CG TYR A 28 -7.953 39.341 -21.692 1.00 43.12 C ATOM 314 CD1 TYR A 28 -9.006 38.828 -22.428 1.00 40.50 C ATOM 315 CD2 TYR A 28 -6.659 39.152 -22.169 1.00 36.95 C ATOM 316 CE1 TYR A 28 -8.789 38.218 -23.643 1.00 38.01 C ATOM 317 CE2 TYR A 28 -6.431 38.474 -23.357 1.00 48.45 C ATOM 318 CZ TYR A 28 -7.502 38.016 -24.083 1.00 31.36 C ATOM 319 OH TYR A 28 -7.307 37.394 -25.297 1.00 50.20 O ATOM 320 HA TYR A 28 -7.162 38.697 -19.181 1.00 0.00 H ATOM 321 HB3 TYR A 28 -7.490 40.932 -20.380 1.00 0.00 H ATOM 322 HB2 TYR A 28 -9.217 40.515 -20.472 1.00 0.00 H ATOM 323 HD2 TYR A 28 -5.814 39.542 -21.601 1.00 0.00 H ATOM 324 HE2 TYR A 28 -5.413 38.307 -23.710 1.00 0.00 H ATOM 325 HE1 TYR A 28 -9.633 37.897 -24.253 1.00 0.00 H ATOM 326 HD1 TYR A 28 -10.022 38.908 -22.041 1.00 0.00 H ATOM 327 HH TYR A 28 -6.851 38.017 -25.916 1.00 0.00 H ATOM 328 H TYR A 28 -10.113 38.644 -19.441 1.00 0.00 H ATOM 329 N LEU A 29 -6.927 40.719 -17.569 1.00 32.16 N ATOM 330 CA LEU A 29 -6.877 41.831 -16.620 1.00 33.74 C ATOM 331 C LEU A 29 -7.015 43.075 -17.487 1.00 29.68 C ATOM 332 O LEU A 29 -6.150 43.335 -18.309 1.00 32.83 O ATOM 333 CB LEU A 29 -5.558 41.859 -15.851 1.00 30.63 C ATOM 334 CG LEU A 29 -5.298 43.099 -14.964 1.00 29.66 C ATOM 335 CD1 LEU A 29 -6.418 43.210 -13.944 1.00 24.32 C ATOM 336 CD2 LEU A 29 -3.982 42.878 -14.229 1.00 32.29 C ATOM 337 HA LEU A 29 -7.658 41.752 -15.864 1.00 0.00 H ATOM 338 HB2 LEU A 29 -5.532 40.980 -15.207 1.00 0.00 H ATOM 339 HB3 LEU A 29 -4.749 41.798 -16.579 1.00 0.00 H ATOM 340 HG LEU A 29 -5.255 44.006 -15.567 1.00 0.00 H ATOM 341 HD21 LEU A 29 -4.057 41.981 -13.614 1.00 0.00 H ATOM 342 HD22 LEU A 29 -3.178 42.756 -14.955 1.00 0.00 H ATOM 343 HD23 LEU A 29 -3.773 43.739 -13.594 1.00 0.00 H ATOM 344 HD11 LEU A 29 -7.371 43.318 -14.463 1.00 0.00 H ATOM 345 HD12 LEU A 29 -6.438 42.311 -13.328 1.00 0.00 H ATOM 346 HD13 LEU A 29 -6.247 44.081 -13.312 1.00 0.00 H ATOM 347 H LEU A 29 -6.046 40.276 -17.900 1.00 0.00 H ATOM 348 N ARG A 30 -8.205 43.687 -17.456 1.00 28.66 N ATOM 349 CA ARG A 30 -8.547 44.795 -18.341 1.00 31.40 C ATOM 350 C ARG A 30 -8.004 46.138 -17.854 1.00 35.45 C ATOM 351 O ARG A 30 -7.492 46.933 -18.647 1.00 35.15 O ATOM 352 CB ARG A 30 -10.069 44.859 -18.547 1.00 28.26 C ATOM 353 CG ARG A 30 -10.576 46.024 -19.407 1.00 30.34 C ATOM 354 CD ARG A 30 -9.986 46.024 -20.832 1.00 28.30 C ATOM 355 NE ARG A 30 -10.418 47.203 -21.582 1.00 33.59 N ATOM 356 CZ ARG A 30 -9.925 48.429 -21.414 1.00 28.35 C ATOM 357 NH1 ARG A 30 -8.948 48.654 -20.545 1.00 37.30 N ATOM 358 NH2 ARG A 30 -10.399 49.434 -22.128 1.00 36.48 N ATOM 359 HA ARG A 30 -8.063 44.601 -19.298 1.00 0.00 H ATOM 360 HB2 ARG A 30 -10.382 43.930 -19.023 1.00 0.00 H ATOM 361 HB3 ARG A 30 -10.537 44.938 -17.566 1.00 0.00 H ATOM 362 HG2 ARG A 30 -11.661 45.955 -19.480 1.00 0.00 H ATOM 363 HG3 ARG A 30 -10.305 46.960 -18.919 1.00 0.00 H ATOM 364 HD2 ARG A 30 -10.319 45.128 -21.355 1.00 0.00 H ATOM 365 HD3 ARG A 30 -8.898 46.022 -20.767 1.00 0.00 H ATOM 366 HE ARG A 30 -11.163 47.075 -22.297 1.00 0.00 H ATOM 367 HH12 ARG A 30 -8.572 49.616 -20.423 1.00 0.00 H ATOM 368 HH11 ARG A 30 -8.558 47.869 -19.986 1.00 0.00 H ATOM 369 HH22 ARG A 30 -10.015 50.391 -21.997 1.00 0.00 H ATOM 370 HH21 ARG A 30 -11.157 49.268 -22.821 1.00 0.00 H ATOM 371 H ARG A 30 -8.916 43.359 -16.772 1.00 0.00 H ATOM 372 N LYS A 31 -8.232 46.450 -16.580 1.00 32.54 N ATOM 373 CA LYS A 31 -7.711 47.699 -15.999 1.00 32.27 C ATOM 374 C LYS A 31 -7.210 47.399 -14.601 1.00 33.52 C ATOM 375 O LYS A 31 -7.835 46.623 -13.893 1.00 29.57 O ATOM 376 CB LYS A 31 -8.815 48.762 -15.891 1.00 34.17 C ATOM 377 CG LYS A 31 -9.539 49.100 -17.194 1.00 37.03 C ATOM 378 CD LYS A 31 -10.540 50.221 -16.983 1.00 39.24 C ATOM 379 CE LYS A 31 -11.317 50.529 -18.262 1.00 44.39 C ATOM 380 NZ LYS A 31 -12.607 51.195 -17.954 1.00 45.83 N ATOM 381 HA LYS A 31 -6.916 48.079 -16.641 1.00 0.00 H ATOM 382 HB2 LYS A 31 -9.557 48.403 -15.178 1.00 0.00 H ATOM 383 HB3 LYS A 31 -8.362 49.678 -15.512 1.00 0.00 H ATOM 384 HG2 LYS A 31 -8.807 49.411 -17.939 1.00 0.00 H ATOM 385 HG3 LYS A 31 -10.065 48.214 -17.550 1.00 0.00 H ATOM 386 HD2 LYS A 31 -11.243 49.926 -16.204 1.00 0.00 H ATOM 387 HD3 LYS A 31 -10.006 51.118 -16.668 1.00 0.00 H ATOM 388 HE2 LYS A 31 -11.514 49.597 -18.793 1.00 0.00 H ATOM 389 HE3 LYS A 31 -10.719 51.186 -18.894 1.00 0.00 H ATOM 390 HZ1 LYS A 31 -13.184 50.570 -17.355 1.00 0.00 H ATOM 391 HZ2 LYS A 31 -12.424 52.087 -17.452 1.00 0.00 H ATOM 392 HZ3 LYS A 31 -13.114 51.393 -18.840 1.00 0.00 H ATOM 393 H LYS A 31 -8.787 45.801 -15.986 1.00 0.00 H ATOM 394 N THR A 32 -6.215 48.164 -14.143 1.00 31.17 N ATOM 395 CA THR A 32 -5.727 48.040 -12.765 1.00 35.67 C ATOM 396 C THR A 32 -5.207 49.388 -12.262 1.00 33.93 C ATOM 397 O THR A 32 -4.856 50.261 -13.062 1.00 32.01 O ATOM 398 CB THR A 32 -4.630 46.927 -12.640 1.00 31.12 C ATOM 399 OG1 THR A 32 -4.149 46.861 -11.293 1.00 34.29 O ATOM 400 CG2 THR A 32 -3.444 47.198 -13.574 1.00 32.33 C ATOM 401 HA THR A 32 -6.564 47.737 -12.136 1.00 0.00 H ATOM 402 HB THR A 32 -5.091 45.981 -12.924 1.00 0.00 H ATOM 403 HG1 THR A 32 -3.457 46.156 -11.225 1.00 0.00 H ATOM 404 HG23 THR A 32 -3.798 47.250 -14.603 1.00 0.00 H ATOM 405 HG21 THR A 32 -2.977 48.144 -13.301 1.00 0.00 H ATOM 406 HG22 THR A 32 -2.717 46.391 -13.479 1.00 0.00 H ATOM 407 H THR A 32 -5.777 48.862 -14.777 1.00 0.00 H ATOM 408 N THR A 33 -5.260 49.601 -10.946 1.00 34.97 N ATOM 409 CA THR A 33 -4.623 50.773 -10.347 1.00 30.51 C ATOM 410 C THR A 33 -3.166 50.484 -9.987 1.00 36.45 C ATOM 411 O THR A 33 -2.492 51.328 -9.405 1.00 34.70 O ATOM 412 CB THR A 33 -5.379 51.276 -9.087 1.00 32.73 C ATOM 413 OG1 THR A 33 -5.439 50.223 -8.115 1.00 30.88 O ATOM 414 CG2 THR A 33 -6.821 51.718 -9.466 1.00 28.54 C ATOM 415 HA THR A 33 -4.659 51.561 -11.100 1.00 0.00 H ATOM 416 HB THR A 33 -4.846 52.131 -8.670 1.00 0.00 H ATOM 417 HG1 THR A 33 -4.520 49.954 -7.864 1.00 0.00 H ATOM 418 HG23 THR A 33 -6.772 52.518 -10.205 1.00 0.00 H ATOM 419 HG21 THR A 33 -7.362 50.869 -9.884 1.00 0.00 H ATOM 420 HG22 THR A 33 -7.336 52.076 -8.575 1.00 0.00 H ATOM 421 H THR A 33 -5.762 48.923 -10.337 1.00 0.00 H ATOM 422 N LYS A 34 -2.697 49.266 -10.245 1.00 34.24 N ATOM 423 CA LYS A 34 -1.280 48.987 -10.022 1.00 35.95 C ATOM 424 C LYS A 34 -0.514 49.178 -11.340 1.00 41.72 C ATOM 425 O LYS A 34 -0.876 48.579 -12.358 1.00 38.35 O ATOM 426 CB LYS A 34 -1.088 47.553 -9.507 1.00 38.25 C ATOM 427 CG LYS A 34 0.362 47.069 -9.493 1.00 33.30 C ATOM 428 CD LYS A 34 0.472 45.697 -8.844 1.00 37.05 C ATOM 429 CE LYS A 34 1.778 44.994 -9.218 1.00 54.57 C ATOM 430 NZ LYS A 34 1.822 43.589 -8.695 1.00 61.67 N ATOM 431 HA LYS A 34 -0.895 49.676 -9.270 1.00 0.00 H ATOM 432 HB2 LYS A 34 -1.473 47.503 -8.488 1.00 0.00 H ATOM 433 HB3 LYS A 34 -1.664 46.883 -10.145 1.00 0.00 H ATOM 434 HG2 LYS A 34 0.728 47.009 -10.518 1.00 0.00 H ATOM 435 HG3 LYS A 34 0.970 47.779 -8.932 1.00 0.00 H ATOM 436 HD2 LYS A 34 0.432 45.815 -7.761 1.00 0.00 H ATOM 437 HD3 LYS A 34 -0.366 45.083 -9.173 1.00 0.00 H ATOM 438 HE2 LYS A 34 2.614 45.554 -8.798 1.00 0.00 H ATOM 439 HE3 LYS A 34 1.868 44.970 -10.304 1.00 0.00 H ATOM 440 HZ1 LYS A 34 1.743 43.604 -7.658 1.00 0.00 H ATOM 441 HZ2 LYS A 34 1.031 43.046 -9.096 1.00 0.00 H ATOM 442 HZ3 LYS A 34 2.722 43.146 -8.969 1.00 0.00 H ATOM 443 H LYS A 34 -3.331 48.522 -10.601 1.00 0.00 H ATOM 444 N PRO A 35 0.558 49.986 -11.317 1.00 39.34 N ATOM 445 CA PRO A 35 1.379 50.197 -12.506 1.00 44.53 C ATOM 446 C PRO A 35 2.392 49.068 -12.721 1.00 44.78 C ATOM 447 O PRO A 35 2.670 48.292 -11.801 1.00 47.60 O ATOM 448 CB PRO A 35 2.107 51.508 -12.187 1.00 48.08 C ATOM 449 CG PRO A 35 2.275 51.465 -10.702 1.00 47.17 C ATOM 450 CD PRO A 35 1.057 50.749 -10.160 1.00 46.27 C ATOM 451 HA PRO A 35 0.785 50.224 -13.419 1.00 0.00 H ATOM 452 HD3 PRO A 35 1.330 50.082 -9.342 1.00 0.00 H ATOM 453 HD2 PRO A 35 0.309 51.462 -9.812 1.00 0.00 H ATOM 454 HG3 PRO A 35 2.330 52.476 -10.298 1.00 0.00 H ATOM 455 HG2 PRO A 35 3.182 50.920 -10.440 1.00 0.00 H ATOM 456 HB2 PRO A 35 3.075 51.548 -12.687 1.00 0.00 H ATOM 457 HB3 PRO A 35 1.509 52.369 -12.486 1.00 0.00 H ATOM 458 N GLY A 36 2.819 48.896 -13.970 1.00 51.74 N ATOM 459 CA GLY A 36 3.880 47.953 -14.304 1.00 46.08 C ATOM 460 C GLY A 36 3.451 46.514 -14.513 1.00 49.44 C ATOM 461 O GLY A 36 4.294 45.617 -14.559 1.00 47.66 O ATOM 462 HA3 GLY A 36 4.608 47.969 -13.493 1.00 0.00 H ATOM 463 HA2 GLY A 36 4.354 48.296 -15.223 1.00 0.00 H ATOM 464 H GLY A 36 2.382 49.452 -14.732 1.00 0.00 H ATOM 465 N THR A 37 2.154 46.270 -14.661 1.00 45.18 N ATOM 466 CA THR A 37 1.706 44.893 -14.865 1.00 52.12 C ATOM 467 C THR A 37 1.902 44.424 -16.321 1.00 52.21 C ATOM 468 O THR A 37 1.816 45.223 -17.256 1.00 54.17 O ATOM 469 CB THR A 37 0.264 44.643 -14.331 1.00 45.67 C ATOM 470 OG1 THR A 37 -0.685 45.396 -15.093 1.00 50.61 O ATOM 471 CG2 THR A 37 0.170 45.090 -12.882 1.00 50.74 C ATOM 472 HA THR A 37 2.355 44.264 -14.256 1.00 0.00 H ATOM 473 HB THR A 37 0.046 43.578 -14.416 1.00 0.00 H ATOM 474 HG1 THR A 37 -0.475 46.361 -15.019 1.00 0.00 H ATOM 475 HG23 THR A 37 0.886 44.528 -12.283 1.00 0.00 H ATOM 476 HG21 THR A 37 0.395 46.154 -12.816 1.00 0.00 H ATOM 477 HG22 THR A 37 -0.839 44.907 -12.511 1.00 0.00 H ATOM 478 H THR A 37 1.465 47.049 -14.632 1.00 0.00 H ATOM 479 N PRO A 38 2.257 43.144 -16.508 1.00 52.09 N ATOM 480 CA PRO A 38 2.523 42.631 -17.857 1.00 51.63 C ATOM 481 C PRO A 38 1.320 42.822 -18.790 1.00 51.95 C ATOM 482 O PRO A 38 0.181 42.645 -18.369 1.00 50.66 O ATOM 483 CB PRO A 38 2.781 41.138 -17.623 1.00 53.12 C ATOM 484 CG PRO A 38 3.070 41.002 -16.160 1.00 55.24 C ATOM 485 CD PRO A 38 2.307 42.089 -15.484 1.00 53.42 C ATOM 486 HA PRO A 38 3.351 43.150 -18.339 1.00 0.00 H ATOM 487 HD3 PRO A 38 1.305 41.756 -15.215 1.00 0.00 H ATOM 488 HD2 PRO A 38 2.826 42.435 -14.590 1.00 0.00 H ATOM 489 HG3 PRO A 38 4.138 41.116 -15.973 1.00 0.00 H ATOM 490 HG2 PRO A 38 2.741 40.028 -15.798 1.00 0.00 H ATOM 491 HB2 PRO A 38 1.902 40.553 -17.893 1.00 0.00 H ATOM 492 HB3 PRO A 38 3.634 40.802 -18.212 1.00 0.00 H ATOM 493 N GLU A 39 1.575 43.262 -20.021 1.00 46.85 N ATOM 494 CA GLU A 39 0.531 43.409 -21.035 1.00 44.80 C ATOM 495 C GLU A 39 -0.174 42.073 -21.246 1.00 40.88 C ATOM 496 O GLU A 39 0.455 41.019 -21.165 1.00 37.29 O ATOM 497 CB GLU A 39 1.159 43.869 -22.370 1.00 49.99 C ATOM 498 CG GLU A 39 2.432 43.100 -22.733 1.00 46.83 C ATOM 499 CD GLU A 39 2.943 43.330 -24.170 1.00 54.44 C ATOM 500 OE1 GLU A 39 2.644 44.378 -24.799 1.00 41.06 O ATOM 501 OE2 GLU A 39 3.704 42.458 -24.649 1.00 48.36 O ATOM 502 HA GLU A 39 -0.190 44.153 -20.696 1.00 0.00 H ATOM 503 HB2 GLU A 39 0.428 43.725 -23.165 1.00 0.00 H ATOM 504 HB3 GLU A 39 1.404 44.928 -22.291 1.00 0.00 H ATOM 505 HG2 GLU A 39 3.219 43.401 -22.041 1.00 0.00 H ATOM 506 HG3 GLU A 39 2.231 42.036 -22.611 1.00 0.00 H ATOM 507 H GLU A 39 2.554 43.510 -20.271 1.00 0.00 H ATOM 508 N CYS A 40 -1.486 42.127 -21.465 1.00 41.99 N ATOM 509 CA CYS A 40 -2.294 40.949 -21.812 1.00 40.59 C ATOM 510 C CYS A 40 -2.304 39.858 -20.750 1.00 40.23 C ATOM 511 O CYS A 40 -2.465 38.673 -21.073 1.00 36.39 O ATOM 512 CB CYS A 40 -1.875 40.360 -23.165 1.00 40.08 C ATOM 513 SG CYS A 40 -1.652 41.566 -24.501 1.00 50.66 S ATOM 514 HA CYS A 40 -3.316 41.323 -21.877 1.00 0.00 H ATOM 515 HB2 CYS A 40 -2.642 39.651 -23.476 1.00 0.00 H ATOM 516 HB3 CYS A 40 -0.931 39.834 -23.025 1.00 0.00 H ATOM 517 H CYS A 40 -1.963 43.048 -21.387 1.00 0.00 H ATOM 518 N ALA A 41 -2.184 40.260 -19.486 1.00 34.85 N ATOM 519 CA ALA A 41 -2.215 39.321 -18.366 1.00 38.05 C ATOM 520 C ALA A 41 -3.594 38.669 -18.304 1.00 35.77 C ATOM 521 O ALA A 41 -4.602 39.323 -18.566 1.00 35.46 O ATOM 522 CB ALA A 41 -1.894 40.049 -17.051 1.00 39.19 C ATOM 523 HA ALA A 41 -1.460 38.548 -18.512 1.00 0.00 H ATOM 524 HB1 ALA A 41 -0.901 40.493 -17.116 1.00 0.00 H ATOM 525 HB2 ALA A 41 -2.633 40.832 -16.881 1.00 0.00 H ATOM 526 HB3 ALA A 41 -1.921 39.336 -16.227 1.00 0.00 H ATOM 527 H ALA A 41 -2.064 41.274 -19.289 1.00 0.00 H ATOM 528 N TYR A 42 -3.640 37.360 -18.070 1.00 32.90 N ATOM 529 CA TYR A 42 -4.917 36.651 -18.067 1.00 33.74 C ATOM 530 C TYR A 42 -4.861 35.405 -17.187 1.00 31.20 C ATOM 531 O TYR A 42 -3.803 35.004 -16.729 1.00 31.41 O ATOM 532 CB TYR A 42 -5.289 36.205 -19.489 1.00 35.24 C ATOM 533 CG TYR A 42 -4.483 34.997 -19.952 1.00 40.11 C ATOM 534 CD1 TYR A 42 -3.220 35.159 -20.526 1.00 38.35 C ATOM 535 CD2 TYR A 42 -4.957 33.694 -19.756 1.00 29.59 C ATOM 536 CE1 TYR A 42 -2.453 34.064 -20.896 1.00 32.38 C ATOM 537 CE2 TYR A 42 -4.186 32.577 -20.127 1.00 33.64 C ATOM 538 CZ TYR A 42 -2.918 32.781 -20.663 1.00 45.69 C ATOM 539 OH TYR A 42 -2.129 31.711 -21.047 1.00 44.88 O ATOM 540 HA TYR A 42 -5.662 37.343 -17.675 1.00 0.00 H ATOM 541 HB3 TYR A 42 -5.105 37.032 -20.175 1.00 0.00 H ATOM 542 HB2 TYR A 42 -6.348 35.947 -19.509 1.00 0.00 H ATOM 543 HD2 TYR A 42 -5.939 33.543 -19.309 1.00 0.00 H ATOM 544 HE2 TYR A 42 -4.576 31.567 -19.997 1.00 0.00 H ATOM 545 HE1 TYR A 42 -1.483 34.214 -21.371 1.00 0.00 H ATOM 546 HD1 TYR A 42 -2.830 36.164 -20.686 1.00 0.00 H ATOM 547 HH TYR A 42 -1.269 32.048 -21.402 1.00 0.00 H ATOM 548 H TYR A 42 -2.760 36.837 -17.888 1.00 0.00 H ATOM 549 N VAL A 43 -6.039 34.927 -16.810 1.00 35.68 N ATOM 550 CA VAL A 43 -6.181 33.645 -16.147 1.00 33.77 C ATOM 551 C VAL A 43 -7.174 32.863 -16.984 1.00 31.39 C ATOM 552 O VAL A 43 -7.984 33.459 -17.688 1.00 37.29 O ATOM 553 CB VAL A 43 -6.757 33.783 -14.704 1.00 35.12 C ATOM 554 CG1 VAL A 43 -5.766 34.466 -13.790 1.00 39.06 C ATOM 555 CG2 VAL A 43 -8.124 34.505 -14.704 1.00 38.23 C ATOM 556 HA VAL A 43 -5.207 33.165 -16.058 1.00 0.00 H ATOM 557 HB VAL A 43 -6.927 32.779 -14.317 1.00 0.00 H ATOM 558 HG11 VAL A 43 -4.849 33.879 -13.747 1.00 0.00 H ATOM 559 HG12 VAL A 43 -5.544 35.461 -14.176 1.00 0.00 H ATOM 560 HG13 VAL A 43 -6.193 34.549 -12.791 1.00 0.00 H ATOM 561 HG21 VAL A 43 -8.006 35.503 -15.125 1.00 0.00 H ATOM 562 HG22 VAL A 43 -8.834 33.937 -15.306 1.00 0.00 H ATOM 563 HG23 VAL A 43 -8.493 34.582 -13.681 1.00 0.00 H ATOM 564 H VAL A 43 -6.892 35.492 -16.997 1.00 0.00 H ATOM 565 N LEU A 44 -7.060 31.533 -16.960 1.00 33.68 N ATOM 566 CA LEU A 44 -8.080 30.673 -17.543 1.00 31.77 C ATOM 567 C LEU A 44 -8.926 30.128 -16.398 1.00 33.05 C ATOM 568 O LEU A 44 -8.390 29.840 -15.324 1.00 38.96 O ATOM 569 CB LEU A 44 -7.431 29.494 -18.288 1.00 32.29 C ATOM 570 CG LEU A 44 -6.710 29.782 -19.613 1.00 35.87 C ATOM 571 CD1 LEU A 44 -6.325 28.462 -20.305 1.00 40.75 C ATOM 572 CD2 LEU A 44 -7.598 30.593 -20.531 1.00 32.16 C ATOM 573 HA LEU A 44 -8.683 31.240 -18.252 1.00 0.00 H ATOM 574 HB2 LEU A 44 -6.701 29.047 -17.613 1.00 0.00 H ATOM 575 HB3 LEU A 44 -8.219 28.771 -18.499 1.00 0.00 H ATOM 576 HG LEU A 44 -5.807 30.352 -19.396 1.00 0.00 H ATOM 577 HD21 LEU A 44 -8.511 30.035 -20.737 1.00 0.00 H ATOM 578 HD22 LEU A 44 -7.849 31.538 -20.050 1.00 0.00 H ATOM 579 HD23 LEU A 44 -7.071 30.788 -21.465 1.00 0.00 H ATOM 580 HD11 LEU A 44 -5.663 27.892 -19.654 1.00 0.00 H ATOM 581 HD12 LEU A 44 -7.226 27.883 -20.506 1.00 0.00 H ATOM 582 HD13 LEU A 44 -5.815 28.680 -21.243 1.00 0.00 H ATOM 583 H LEU A 44 -6.225 31.102 -16.515 1.00 0.00 H ATOM 584 N VAL A 45 -10.232 29.974 -16.618 1.00 31.59 N ATOM 585 CA VAL A 45 -11.080 29.310 -15.620 1.00 36.40 C ATOM 586 C VAL A 45 -10.588 27.857 -15.412 1.00 36.54 C ATOM 587 O VAL A 45 -10.031 27.259 -16.336 1.00 40.31 O ATOM 588 CB VAL A 45 -12.586 29.351 -16.007 1.00 36.36 C ATOM 589 CG1 VAL A 45 -12.988 30.744 -16.472 1.00 35.45 C ATOM 590 CG2 VAL A 45 -12.922 28.285 -17.056 1.00 39.58 C ATOM 591 HA VAL A 45 -10.994 29.855 -14.680 1.00 0.00 H ATOM 592 HB VAL A 45 -13.169 29.119 -15.116 1.00 0.00 H ATOM 593 HG11 VAL A 45 -12.812 31.459 -15.668 1.00 0.00 H ATOM 594 HG12 VAL A 45 -12.394 31.021 -17.343 1.00 0.00 H ATOM 595 HG13 VAL A 45 -14.045 30.746 -16.737 1.00 0.00 H ATOM 596 HG21 VAL A 45 -12.328 28.460 -17.953 1.00 0.00 H ATOM 597 HG22 VAL A 45 -12.694 27.298 -16.655 1.00 0.00 H ATOM 598 HG23 VAL A 45 -13.982 28.342 -17.303 1.00 0.00 H ATOM 599 H VAL A 45 -10.652 30.326 -17.502 1.00 0.00 H ATOM 600 N PRO A 46 -10.600 27.367 -14.157 1.00 34.54 N ATOM 601 CA PRO A 46 -9.996 26.058 -13.890 1.00 38.73 C ATOM 602 C PRO A 46 -10.653 24.980 -14.738 1.00 41.84 C ATOM 603 O PRO A 46 -11.790 25.154 -15.193 1.00 42.30 O ATOM 604 CB PRO A 46 -10.295 25.828 -12.405 1.00 42.17 C ATOM 605 CG PRO A 46 -10.488 27.194 -11.858 1.00 36.87 C ATOM 606 CD PRO A 46 -11.168 27.959 -12.936 1.00 34.09 C ATOM 607 HA PRO A 46 -8.932 26.023 -14.125 1.00 0.00 H ATOM 608 HD3 PRO A 46 -12.248 27.820 -12.897 1.00 0.00 H ATOM 609 HD2 PRO A 46 -10.938 29.022 -12.870 1.00 0.00 H ATOM 610 HG3 PRO A 46 -9.527 27.648 -11.616 1.00 0.00 H ATOM 611 HG2 PRO A 46 -11.109 27.162 -10.963 1.00 0.00 H ATOM 612 HB2 PRO A 46 -11.198 25.230 -12.280 1.00 0.00 H ATOM 613 HB3 PRO A 46 -9.459 25.329 -11.915 1.00 0.00 H ATOM 614 N GLN A 47 -9.932 23.896 -14.990 1.00 46.12 N ATOM 615 CA GLN A 47 -10.426 22.882 -15.911 1.00 49.83 C ATOM 616 C GLN A 47 -11.648 22.138 -15.358 1.00 52.07 C ATOM 617 O GLN A 47 -12.501 21.649 -16.111 1.00 51.67 O ATOM 618 CB GLN A 47 -9.307 21.918 -16.295 1.00 49.26 C ATOM 619 CG GLN A 47 -9.528 21.252 -17.639 1.00 63.32 C ATOM 620 CD GLN A 47 -8.228 20.915 -18.337 1.00 73.96 C ATOM 621 OE1 GLN A 47 -7.233 20.577 -17.692 1.00 79.26 O ATOM 622 NE2 GLN A 47 -8.224 21.024 -19.663 1.00 62.50 N ATOM 623 HA GLN A 47 -10.762 23.394 -16.813 1.00 0.00 H ATOM 624 HB2 GLN A 47 -8.369 22.472 -16.333 1.00 0.00 H ATOM 625 HB3 GLN A 47 -9.239 21.143 -15.531 1.00 0.00 H ATOM 626 HG2 GLN A 47 -10.092 20.332 -17.486 1.00 0.00 H ATOM 627 HG3 GLN A 47 -10.102 21.927 -18.274 1.00 0.00 H ATOM 628 HE22 GLN A 47 -9.089 21.313 -20.164 1.00 0.00 H ATOM 629 HE21 GLN A 47 -7.356 20.820 -20.199 1.00 0.00 H ATOM 630 H GLN A 47 -9.009 23.769 -14.528 1.00 0.00 H ATOM 631 N ASN A 48 -11.770 22.138 -14.038 1.00 53.08 N ATOM 632 CA ASN A 48 -12.899 21.500 -13.375 1.00 54.19 C ATOM 633 C ASN A 48 -13.632 22.461 -12.439 1.00 53.63 C ATOM 634 O ASN A 48 -13.034 23.390 -11.889 1.00 52.54 O ATOM 635 CB ASN A 48 -12.429 20.261 -12.617 1.00 53.07 C ATOM 636 CG ASN A 48 -11.102 20.475 -11.928 1.00 60.28 C ATOM 637 OD1 ASN A 48 -10.371 21.420 -12.241 1.00 61.30 O ATOM 638 ND2 ASN A 48 -10.770 19.588 -10.997 1.00 64.55 N ATOM 639 HA ASN A 48 -13.610 21.200 -14.145 1.00 0.00 H ATOM 640 HB2 ASN A 48 -13.176 20.006 -11.866 1.00 0.00 H ATOM 641 HB3 ASN A 48 -12.328 19.436 -13.322 1.00 0.00 H ATOM 642 HD22 ASN A 48 -11.418 18.808 -10.767 1.00 0.00 H ATOM 643 HD21 ASN A 48 -9.862 19.673 -10.498 1.00 0.00 H ATOM 644 H ASN A 48 -11.041 22.605 -13.461 1.00 0.00 H ATOM 645 N THR A 49 -14.942 22.271 -12.320 1.00 49.35 N ATOM 646 CA THR A 49 -15.769 23.153 -11.508 1.00 47.77 C ATOM 647 C THR A 49 -15.332 23.210 -10.042 1.00 45.39 C ATOM 648 O THR A 49 -14.959 22.195 -9.450 1.00 40.48 O ATOM 649 CB THR A 49 -17.258 22.802 -11.633 1.00 46.33 C ATOM 650 OG1 THR A 49 -17.675 23.005 -12.990 1.00 47.85 O ATOM 651 CG2 THR A 49 -18.097 23.686 -10.725 1.00 48.49 C ATOM 652 HA THR A 49 -15.622 24.156 -11.909 1.00 0.00 H ATOM 653 HB THR A 49 -17.397 21.761 -11.341 1.00 0.00 H ATOM 654 HG1 THR A 49 -18.635 22.780 -13.076 1.00 0.00 H ATOM 655 HG23 THR A 49 -17.788 23.539 -9.690 1.00 0.00 H ATOM 656 HG21 THR A 49 -17.954 24.730 -11.004 1.00 0.00 H ATOM 657 HG22 THR A 49 -19.149 23.421 -10.832 1.00 0.00 H ATOM 658 H THR A 49 -15.387 21.474 -12.818 1.00 0.00 H ATOM 659 N LEU A 50 -15.141 24.434 -9.559 1.00 43.48 N ATOM 660 CA LEU A 50 -14.845 24.683 -8.155 1.00 39.11 C ATOM 661 C LEU A 50 -16.142 24.797 -7.373 1.00 41.25 C ATOM 662 O LEU A 50 -17.136 25.320 -7.881 1.00 40.76 O ATOM 663 CB LEU A 50 -14.085 26.003 -8.000 1.00 42.67 C ATOM 664 CG LEU A 50 -12.561 25.974 -7.961 1.00 41.71 C ATOM 665 CD1 LEU A 50 -12.029 27.419 -7.835 1.00 44.98 C ATOM 666 CD2 LEU A 50 -12.103 25.118 -6.792 1.00 37.40 C ATOM 667 HA LEU A 50 -14.241 23.857 -7.780 1.00 0.00 H ATOM 668 HB2 LEU A 50 -14.372 26.638 -8.838 1.00 0.00 H ATOM 669 HB3 LEU A 50 -14.421 26.459 -7.068 1.00 0.00 H ATOM 670 HG LEU A 50 -12.167 25.539 -8.880 1.00 0.00 H ATOM 671 HD21 LEU A 50 -12.484 25.541 -5.862 1.00 0.00 H ATOM 672 HD22 LEU A 50 -12.484 24.104 -6.914 1.00 0.00 H ATOM 673 HD23 LEU A 50 -11.014 25.097 -6.764 1.00 0.00 H ATOM 674 HD11 LEU A 50 -12.363 28.004 -8.692 1.00 0.00 H ATOM 675 HD12 LEU A 50 -12.411 27.867 -6.917 1.00 0.00 H ATOM 676 HD13 LEU A 50 -10.939 27.403 -7.807 1.00 0.00 H ATOM 677 H LEU A 50 -15.205 25.244 -10.208 1.00 0.00 H ATOM 678 N SER A 51 -16.132 24.264 -6.157 1.00 37.11 N ATOM 679 CA SER A 51 -17.201 24.483 -5.200 1.00 41.09 C ATOM 680 C SER A 51 -16.525 25.130 -4.003 1.00 38.00 C ATOM 681 O SER A 51 -15.315 25.266 -3.991 1.00 32.44 O ATOM 682 CB SER A 51 -17.865 23.161 -4.802 1.00 40.47 C ATOM 683 OG SER A 51 -16.897 22.228 -4.360 1.00 40.91 O ATOM 684 HA SER A 51 -17.994 25.107 -5.612 1.00 0.00 H ATOM 685 HB2 SER A 51 -18.391 22.750 -5.664 1.00 0.00 H ATOM 686 HB3 SER A 51 -18.577 23.346 -3.998 1.00 0.00 H ATOM 687 HG SER A 51 -16.250 22.055 -5.089 1.00 0.00 H ATOM 688 H SER A 51 -15.327 23.667 -5.880 1.00 0.00 H ATOM 689 N GLU A 52 -17.308 25.543 -3.014 1.00 40.25 N ATOM 690 CA GLU A 52 -16.794 26.314 -1.876 1.00 34.97 C ATOM 691 C GLU A 52 -15.675 25.609 -1.111 1.00 37.34 C ATOM 692 O GLU A 52 -15.806 24.442 -0.732 1.00 37.02 O ATOM 693 CB GLU A 52 -17.945 26.648 -0.914 1.00 39.12 C ATOM 694 CG GLU A 52 -17.521 27.402 0.333 1.00 38.48 C ATOM 695 CD GLU A 52 -17.126 28.830 0.025 1.00 36.76 C ATOM 696 OE1 GLU A 52 -17.326 29.249 -1.131 1.00 49.92 O ATOM 697 OE2 GLU A 52 -16.612 29.519 0.927 1.00 44.12 O ATOM 698 HA GLU A 52 -16.360 27.224 -2.291 1.00 0.00 H ATOM 699 HB2 GLU A 52 -18.672 27.257 -1.451 1.00 0.00 H ATOM 700 HB3 GLU A 52 -18.413 25.714 -0.605 1.00 0.00 H ATOM 701 HG2 GLU A 52 -18.352 27.411 1.039 1.00 0.00 H ATOM 702 HG3 GLU A 52 -16.670 26.890 0.782 1.00 0.00 H ATOM 703 H GLU A 52 -18.322 25.312 -3.047 1.00 0.00 H ATOM 704 N GLY A 53 -14.636 26.364 -0.772 1.00 34.11 N ATOM 705 CA GLY A 53 -13.529 25.854 0.046 1.00 39.26 C ATOM 706 C GLY A 53 -12.464 25.010 -0.648 1.00 34.89 C ATOM 707 O GLY A 53 -11.502 24.577 -0.019 1.00 37.88 O ATOM 708 HA3 GLY A 53 -13.963 25.244 0.838 1.00 0.00 H ATOM 709 HA2 GLY A 53 -13.026 26.715 0.487 1.00 0.00 H ATOM 710 H GLY A 53 -14.606 27.351 -1.098 1.00 0.00 H ATOM 711 N GLN A 54 -12.638 24.760 -1.938 1.00 36.79 N ATOM 712 CA GLN A 54 -11.740 23.861 -2.659 1.00 40.32 C ATOM 713 C GLN A 54 -10.506 24.560 -3.209 1.00 40.15 C ATOM 714 O GLN A 54 -10.477 25.793 -3.327 1.00 39.24 O ATOM 715 CB GLN A 54 -12.475 23.135 -3.786 1.00 44.36 C ATOM 716 CG GLN A 54 -13.518 22.156 -3.305 1.00 46.98 C ATOM 717 CD GLN A 54 -14.181 21.402 -4.437 1.00 56.75 C ATOM 718 OE1 GLN A 54 -14.269 22.033 -5.600 1.00 49.89 O ATOM 719 NE2 GLN A 54 -14.605 20.260 -4.267 1.00 46.08 N ATOM 720 HA GLN A 54 -11.395 23.133 -1.925 1.00 0.00 H ATOM 721 HB2 GLN A 54 -12.966 23.880 -4.412 1.00 0.00 H ATOM 722 HB3 GLN A 54 -11.741 22.591 -4.380 1.00 0.00 H ATOM 723 HG2 GLN A 54 -13.040 21.437 -2.640 1.00 0.00 H ATOM 724 HG3 GLN A 54 -14.284 22.704 -2.756 1.00 0.00 H ATOM 725 HE22 GLN A 54 -14.514 19.805 -3.336 1.00 0.00 H ATOM 726 HE21 GLN A 54 -15.055 19.750 -5.054 1.00 0.00 H ATOM 727 H GLN A 54 -13.426 25.211 -2.445 1.00 0.00 H ATOM 728 N SER A 55 -9.456 23.770 -3.429 1.00 36.60 N ATOM 729 CA SER A 55 -8.231 24.227 -4.088 1.00 38.64 C ATOM 730 C SER A 55 -8.135 23.526 -5.419 1.00 39.02 C ATOM 731 O SER A 55 -8.620 22.405 -5.573 1.00 42.37 O ATOM 732 CB SER A 55 -7.005 23.878 -3.250 1.00 36.98 C ATOM 733 OG SER A 55 -6.970 24.640 -2.060 1.00 41.67 O ATOM 734 HA SER A 55 -8.264 25.309 -4.213 1.00 0.00 H ATOM 735 HB2 SER A 55 -6.106 24.083 -3.831 1.00 0.00 H ATOM 736 HB3 SER A 55 -7.038 22.819 -2.994 1.00 0.00 H ATOM 737 HG SER A 55 -6.936 25.603 -2.287 1.00 0.00 H ATOM 738 H SER A 55 -9.509 22.779 -3.117 1.00 0.00 H ATOM 739 N THR A 56 -7.506 24.172 -6.389 1.00 36.23 N ATOM 740 CA THR A 56 -7.395 23.585 -7.719 1.00 47.21 C ATOM 741 C THR A 56 -6.288 24.288 -8.484 1.00 45.99 C ATOM 742 O THR A 56 -5.804 25.330 -8.050 1.00 40.89 O ATOM 743 CB THR A 56 -8.719 23.717 -8.507 1.00 47.54 C ATOM 744 OG1 THR A 56 -8.767 22.740 -9.555 1.00 47.74 O ATOM 745 CG2 THR A 56 -8.845 25.113 -9.111 1.00 45.71 C ATOM 746 HA THR A 56 -7.169 22.525 -7.606 1.00 0.00 H ATOM 747 HB THR A 56 -9.546 23.552 -7.817 1.00 0.00 H ATOM 748 HG1 THR A 56 -9.618 22.833 -10.053 1.00 0.00 H ATOM 749 HG23 THR A 56 -8.809 25.857 -8.315 1.00 0.00 H ATOM 750 HG21 THR A 56 -8.023 25.282 -9.806 1.00 0.00 H ATOM 751 HG22 THR A 56 -9.794 25.193 -9.642 1.00 0.00 H ATOM 752 H THR A 56 -7.088 25.105 -6.201 1.00 0.00 H ATOM 753 N SER A 57 -5.807 23.652 -9.547 1.00 48.51 N ATOM 754 CA SER A 57 -4.813 24.270 -10.421 1.00 43.18 C ATOM 755 C SER A 57 -5.522 25.175 -11.403 1.00 42.65 C ATOM 756 O SER A 57 -6.657 24.905 -11.794 1.00 36.78 O ATOM 757 CB SER A 57 -4.059 23.195 -11.225 1.00 51.36 C ATOM 758 OG SER A 57 -3.355 22.303 -10.387 1.00 52.74 O ATOM 759 HA SER A 57 -4.107 24.829 -9.807 1.00 0.00 H ATOM 760 HB2 SER A 57 -3.350 23.686 -11.891 1.00 0.00 H ATOM 761 HB3 SER A 57 -4.778 22.629 -11.817 1.00 0.00 H ATOM 762 HG SER A 57 -2.886 21.631 -10.942 1.00 0.00 H ATOM 763 H SER A 57 -6.146 22.692 -9.762 1.00 0.00 H ATOM 764 N PHE A 58 -4.829 26.219 -11.859 1.00 41.53 N ATOM 765 CA PHE A 58 -5.353 27.044 -12.932 1.00 40.28 C ATOM 766 C PHE A 58 -4.194 27.589 -13.733 1.00 34.86 C ATOM 767 O PHE A 58 -3.061 27.620 -13.253 1.00 37.24 O ATOM 768 CB PHE A 58 -6.222 28.191 -12.396 1.00 37.86 C ATOM 769 CG PHE A 58 -5.442 29.277 -11.713 1.00 35.55 C ATOM 770 CD1 PHE A 58 -4.952 29.091 -10.434 1.00 31.08 C ATOM 771 CD2 PHE A 58 -5.201 30.484 -12.351 1.00 36.08 C ATOM 772 CE1 PHE A 58 -4.185 30.050 -9.832 1.00 32.27 C ATOM 773 CE2 PHE A 58 -4.451 31.460 -11.749 1.00 30.02 C ATOM 774 CZ PHE A 58 -3.962 31.260 -10.468 1.00 39.92 C ATOM 775 HA PHE A 58 -5.993 26.431 -13.567 1.00 0.00 H ATOM 776 HB2 PHE A 58 -6.764 28.632 -13.233 1.00 0.00 H ATOM 777 HB3 PHE A 58 -6.934 27.778 -11.681 1.00 0.00 H ATOM 778 HD2 PHE A 58 -5.614 30.659 -13.345 1.00 0.00 H ATOM 779 HE2 PHE A 58 -4.240 32.390 -12.276 1.00 0.00 H ATOM 780 HZ PHE A 58 -3.405 32.050 -9.964 1.00 0.00 H ATOM 781 HE1 PHE A 58 -3.749 29.862 -8.851 1.00 0.00 H ATOM 782 HD1 PHE A 58 -5.180 28.169 -9.899 1.00 0.00 H ATOM 783 H PHE A 58 -3.904 26.444 -11.441 1.00 0.00 H ATOM 784 N THR A 59 -4.459 27.870 -14.999 1.00 39.63 N ATOM 785 CA THR A 59 -3.451 28.426 -15.895 1.00 43.18 C ATOM 786 C THR A 59 -3.566 29.947 -15.919 1.00 42.11 C ATOM 787 O THR A 59 -4.666 30.497 -15.832 1.00 35.93 O ATOM 788 CB THR A 59 -3.623 27.879 -17.317 1.00 42.65 C ATOM 789 OG1 THR A 59 -3.586 26.443 -17.286 1.00 47.57 O ATOM 790 CG2 THR A 59 -2.522 28.405 -18.255 1.00 39.49 C ATOM 791 HA THR A 59 -2.467 28.136 -15.527 1.00 0.00 H ATOM 792 HB THR A 59 -4.585 28.218 -17.700 1.00 0.00 H ATOM 793 HG1 THR A 59 -3.697 26.091 -18.205 1.00 0.00 H ATOM 794 HG23 THR A 59 -2.554 29.494 -18.275 1.00 0.00 H ATOM 795 HG21 THR A 59 -1.549 28.075 -17.891 1.00 0.00 H ATOM 796 HG22 THR A 59 -2.687 28.017 -19.260 1.00 0.00 H ATOM 797 H THR A 59 -5.415 27.689 -15.366 1.00 0.00 H ATOM 798 N TYR A 60 -2.419 30.610 -15.981 1.00 36.85 N ATOM 799 CA TYR A 60 -2.359 32.057 -16.091 1.00 36.66 C ATOM 800 C TYR A 60 -1.182 32.424 -16.974 1.00 37.40 C ATOM 801 O TYR A 60 -0.343 31.570 -17.311 1.00 40.17 O ATOM 802 CB TYR A 60 -2.215 32.703 -14.718 1.00 39.16 C ATOM 803 CG TYR A 60 -0.853 32.540 -14.098 1.00 48.47 C ATOM 804 CD1 TYR A 60 -0.541 31.408 -13.361 1.00 42.01 C ATOM 805 CD2 TYR A 60 0.112 33.546 -14.205 1.00 41.06 C ATOM 806 CE1 TYR A 60 0.709 31.246 -12.797 1.00 43.38 C ATOM 807 CE2 TYR A 60 1.362 33.399 -13.624 1.00 44.90 C ATOM 808 CZ TYR A 60 1.654 32.238 -12.923 1.00 53.26 C ATOM 809 OH TYR A 60 2.881 32.078 -12.306 1.00 47.17 O ATOM 810 HA TYR A 60 -3.285 32.426 -16.531 1.00 0.00 H ATOM 811 HB3 TYR A 60 -2.951 32.254 -14.050 1.00 0.00 H ATOM 812 HB2 TYR A 60 -2.420 33.769 -14.818 1.00 0.00 H ATOM 813 HD2 TYR A 60 -0.122 34.459 -14.753 1.00 0.00 H ATOM 814 HE2 TYR A 60 2.108 34.188 -13.717 1.00 0.00 H ATOM 815 HE1 TYR A 60 0.947 30.332 -12.252 1.00 0.00 H ATOM 816 HD1 TYR A 60 -1.295 30.633 -13.224 1.00 0.00 H ATOM 817 HH TYR A 60 3.008 32.795 -11.635 1.00 0.00 H ATOM 818 H TYR A 60 -1.529 30.073 -15.950 1.00 0.00 H ATOM 819 N GLY A 61 -1.201 33.638 -17.494 1.00 37.21 N ATOM 820 CA GLY A 61 -0.171 34.017 -18.435 1.00 35.57 C ATOM 821 C GLY A 61 -0.208 35.462 -18.839 1.00 37.14 C ATOM 822 O GLY A 61 -0.792 36.309 -18.165 1.00 37.94 O ATOM 823 HA3 GLY A 61 -0.286 33.408 -19.332 1.00 0.00 H ATOM 824 HA2 GLY A 61 0.799 33.813 -17.981 1.00 0.00 H ATOM 825 H GLY A 61 -1.947 34.313 -17.230 1.00 0.00 H ATOM 826 N LYS A 62 0.431 35.730 -19.962 1.00 38.23 N ATOM 827 CA LYS A 62 0.624 37.079 -20.425 1.00 38.41 C ATOM 828 C LYS A 62 1.290 36.969 -21.792 1.00 40.83 C ATOM 829 O LYS A 62 1.719 35.880 -22.195 1.00 38.22 O ATOM 830 CB LYS A 62 1.544 37.808 -19.451 1.00 39.37 C ATOM 831 CG LYS A 62 2.965 37.264 -19.440 1.00 50.77 C ATOM 832 CD LYS A 62 3.874 38.158 -18.624 1.00 67.11 C ATOM 833 CE LYS A 62 5.045 37.384 -18.050 1.00 74.65 C ATOM 834 NZ LYS A 62 5.793 38.214 -17.062 1.00 79.00 N ATOM 835 HA LYS A 62 -0.314 37.630 -20.491 1.00 0.00 H ATOM 836 HB2 LYS A 62 1.579 38.861 -19.731 1.00 0.00 H ATOM 837 HB3 LYS A 62 1.130 37.713 -18.447 1.00 0.00 H ATOM 838 HG2 LYS A 62 2.962 36.264 -19.006 1.00 0.00 H ATOM 839 HG3 LYS A 62 3.337 37.213 -20.463 1.00 0.00 H ATOM 840 HD2 LYS A 62 4.255 38.955 -19.263 1.00 0.00 H ATOM 841 HD3 LYS A 62 3.301 38.593 -17.805 1.00 0.00 H ATOM 842 HE2 LYS A 62 5.717 37.099 -18.860 1.00 0.00 H ATOM 843 HE3 LYS A 62 4.673 36.487 -17.555 1.00 0.00 H ATOM 844 HZ1 LYS A 62 6.153 39.069 -17.532 1.00 0.00 H ATOM 845 HZ2 LYS A 62 5.156 38.485 -16.286 1.00 0.00 H ATOM 846 HZ3 LYS A 62 6.590 37.664 -16.682 1.00 0.00 H ATOM 847 H LYS A 62 0.806 34.943 -20.529 1.00 0.00 H ATOM 848 N LEU A 63 1.322 38.079 -22.520 1.00 41.85 N ATOM 849 CA LEU A 63 1.928 38.111 -23.843 1.00 40.84 C ATOM 850 C LEU A 63 3.444 38.144 -23.746 1.00 46.99 C ATOM 851 O LEU A 63 4.017 38.892 -22.949 1.00 38.07 O ATOM 852 CB LEU A 63 1.430 39.317 -24.635 1.00 37.73 C ATOM 853 CG LEU A 63 2.007 39.473 -26.042 1.00 37.12 C ATOM 854 CD1 LEU A 63 1.687 38.227 -26.858 1.00 39.89 C ATOM 855 CD2 LEU A 63 1.447 40.723 -26.697 1.00 34.72 C ATOM 856 HA LEU A 63 1.634 37.201 -24.366 1.00 0.00 H ATOM 857 HB2 LEU A 63 0.347 39.235 -24.725 1.00 0.00 H ATOM 858 HB3 LEU A 63 1.679 40.215 -24.070 1.00 0.00 H ATOM 859 HG LEU A 63 3.090 39.582 -25.989 1.00 0.00 H ATOM 860 HD21 LEU A 63 0.362 40.643 -26.760 1.00 0.00 H ATOM 861 HD22 LEU A 63 1.714 41.595 -26.100 1.00 0.00 H ATOM 862 HD23 LEU A 63 1.864 40.825 -27.699 1.00 0.00 H ATOM 863 HD11 LEU A 63 2.129 37.355 -26.376 1.00 0.00 H ATOM 864 HD12 LEU A 63 0.606 38.101 -26.918 1.00 0.00 H ATOM 865 HD13 LEU A 63 2.098 38.336 -27.862 1.00 0.00 H ATOM 866 H LEU A 63 0.903 38.949 -22.134 1.00 0.00 H ATOM 867 N GLN A 64 4.095 37.338 -24.580 1.00 53.06 N ATOM 868 CA GLN A 64 5.540 37.273 -24.568 1.00 54.50 C ATOM 869 C GLN A 64 5.906 36.807 -25.966 1.00 51.46 C ATOM 870 O GLN A 64 5.485 35.738 -26.404 1.00 51.18 O ATOM 871 CB GLN A 64 6.034 36.417 -23.404 1.00 55.21 C ATOM 872 CG GLN A 64 7.355 36.902 -22.808 1.00 63.77 C ATOM 873 CD GLN A 64 7.898 35.963 -21.743 1.00 64.14 C ATOM 874 OE1 GLN A 64 7.859 36.268 -20.547 1.00 61.00 O ATOM 875 NE2 GLN A 64 8.364 34.794 -22.169 1.00 61.96 N ATOM 876 HA GLN A 64 6.041 38.222 -24.376 1.00 0.00 H ATOM 877 HB2 GLN A 64 5.276 36.429 -22.620 1.00 0.00 H ATOM 878 HB3 GLN A 64 6.170 35.396 -23.760 1.00 0.00 H ATOM 879 HG2 GLN A 64 8.090 36.984 -23.609 1.00 0.00 H ATOM 880 HG3 GLN A 64 7.197 37.883 -22.360 1.00 0.00 H ATOM 881 HE22 GLN A 64 8.378 34.579 -23.187 1.00 0.00 H ATOM 882 HE21 GLN A 64 8.715 34.094 -21.485 1.00 0.00 H ATOM 883 H GLN A 64 3.559 36.748 -25.248 1.00 0.00 H ATOM 884 N ASN A 65 6.652 37.653 -26.672 1.00 46.31 N ATOM 885 CA ASN A 65 7.182 37.307 -27.977 1.00 46.54 C ATOM 886 C ASN A 65 6.130 36.865 -28.979 1.00 44.03 C ATOM 887 O ASN A 65 6.333 35.911 -29.740 1.00 47.36 O ATOM 888 CB ASN A 65 8.237 36.219 -27.775 1.00 49.50 C ATOM 889 CG ASN A 65 9.431 36.713 -26.981 1.00 53.88 C ATOM 890 OD1 ASN A 65 9.995 37.768 -27.285 1.00 56.53 O ATOM 891 ND2 ASN A 65 9.810 35.967 -25.944 1.00 51.43 N ATOM 892 HA ASN A 65 7.615 38.206 -28.415 1.00 0.00 H ATOM 893 HB2 ASN A 65 7.782 35.384 -27.241 1.00 0.00 H ATOM 894 HB3 ASN A 65 8.582 35.879 -28.752 1.00 0.00 H ATOM 895 HD22 ASN A 65 9.304 35.085 -25.726 1.00 0.00 H ATOM 896 HD21 ASN A 65 10.611 36.267 -25.353 1.00 0.00 H ATOM 897 H ASN A 65 6.862 38.591 -26.276 1.00 0.00 H ATOM 898 N GLY A 66 4.997 37.560 -28.963 1.00 39.57 N ATOM 899 CA GLY A 66 3.922 37.298 -29.908 1.00 43.85 C ATOM 900 C GLY A 66 2.998 36.175 -29.476 1.00 46.60 C ATOM 901 O GLY A 66 1.940 35.974 -30.078 1.00 48.50 O ATOM 902 HA3 GLY A 66 4.363 37.032 -30.868 1.00 0.00 H ATOM 903 HA2 GLY A 66 3.332 38.207 -30.020 1.00 0.00 H ATOM 904 H GLY A 66 4.875 38.312 -28.255 1.00 0.00 H ATOM 905 N GLN A 67 3.354 35.494 -28.390 1.00 45.46 N ATOM 906 CA GLN A 67 2.544 34.379 -27.899 1.00 49.95 C ATOM 907 C GLN A 67 2.080 34.498 -26.450 1.00 47.68 C ATOM 908 O GLN A 67 2.766 35.072 -25.607 1.00 48.35 O ATOM 909 CB GLN A 67 3.276 33.058 -28.110 1.00 44.49 C ATOM 910 CG GLN A 67 3.568 32.764 -29.567 1.00 54.98 C ATOM 911 CD GLN A 67 4.083 31.367 -29.766 1.00 53.12 C ATOM 912 OE1 GLN A 67 4.828 30.869 -28.785 1.00 70.72 O ATOM 913 NE2 GLN A 67 3.752 30.708 -30.752 1.00 59.40 N ATOM 914 HA GLN A 67 1.631 34.412 -28.494 1.00 0.00 H ATOM 915 HB2 GLN A 67 4.221 33.095 -27.568 1.00 0.00 H ATOM 916 HB3 GLN A 67 2.660 32.252 -27.710 1.00 0.00 H ATOM 917 HG2 GLN A 67 2.650 32.886 -30.142 1.00 0.00 H ATOM 918 HG3 GLN A 67 4.317 33.470 -29.926 1.00 0.00 H ATOM 919 HE22 GLN A 67 3.167 31.142 -31.495 1.00 0.00 H ATOM 920 HE21 GLN A 67 4.057 29.718 -30.842 1.00 0.00 H ATOM 921 H GLN A 67 4.222 35.758 -27.882 1.00 0.00 H ATOM 922 N MET A 68 0.908 33.937 -26.169 1.00 52.62 N ATOM 923 CA MET A 68 0.394 33.863 -24.799 1.00 48.77 C ATOM 924 C MET A 68 1.061 32.689 -24.094 1.00 49.27 C ATOM 925 O MET A 68 0.810 31.531 -24.444 1.00 50.38 O ATOM 926 CB MET A 68 -1.120 33.625 -24.811 1.00 50.06 C ATOM 927 CG MET A 68 -1.957 34.761 -25.364 1.00 50.52 C ATOM 928 SD MET A 68 -1.669 36.283 -24.442 1.00 46.45 S ATOM 929 CE MET A 68 -3.339 36.754 -23.976 1.00 40.08 C ATOM 930 HA MET A 68 0.607 34.800 -24.285 1.00 0.00 H ATOM 931 HB2 MET A 68 -1.316 32.739 -25.415 1.00 0.00 H ATOM 932 HB3 MET A 68 -1.439 33.442 -23.785 1.00 0.00 H ATOM 933 HG2 MET A 68 -3.012 34.495 -25.293 1.00 0.00 H ATOM 934 HG3 MET A 68 -1.694 34.922 -26.409 1.00 0.00 H ATOM 935 HE1 MET A 68 -3.937 36.904 -24.875 1.00 0.00 H ATOM 936 HE2 MET A 68 -3.783 35.963 -23.371 1.00 0.00 H ATOM 937 HE3 MET A 68 -3.307 37.679 -23.401 1.00 0.00 H ATOM 938 H MET A 68 0.340 33.539 -26.944 1.00 0.00 H ATOM 939 N ILE A 69 1.918 32.973 -23.117 1.00 45.53 N ATOM 940 CA ILE A 69 2.553 31.899 -22.355 1.00 45.03 C ATOM 941 C ILE A 69 1.629 31.405 -21.252 1.00 47.53 C ATOM 942 O ILE A 69 0.848 32.184 -20.682 1.00 45.85 O ATOM 943 CB ILE A 69 3.889 32.332 -21.717 1.00 47.60 C ATOM 944 CG1 ILE A 69 3.647 33.419 -20.672 1.00 49.88 C ATOM 945 CG2 ILE A 69 4.909 32.741 -22.794 1.00 54.40 C ATOM 946 CD1 ILE A 69 4.797 33.620 -19.703 1.00 66.22 C ATOM 947 HA ILE A 69 2.756 31.101 -23.069 1.00 0.00 H ATOM 948 HB ILE A 69 4.330 31.483 -21.194 1.00 0.00 H ATOM 949 HG12 ILE A 69 3.470 34.360 -21.193 1.00 0.00 H ATOM 950 HG13 ILE A 69 2.760 33.150 -20.099 1.00 0.00 H ATOM 951 HD11 ILE A 69 4.981 32.692 -19.162 1.00 0.00 H ATOM 952 HD12 ILE A 69 5.692 33.903 -20.257 1.00 0.00 H ATOM 953 HD13 ILE A 69 4.541 34.409 -18.996 1.00 0.00 H ATOM 954 HG21 ILE A 69 5.095 31.895 -23.456 1.00 0.00 H ATOM 955 HG22 ILE A 69 4.511 33.575 -23.372 1.00 0.00 H ATOM 956 HG23 ILE A 69 5.841 33.041 -22.315 1.00 0.00 H ATOM 957 H ILE A 69 2.138 33.965 -22.894 1.00 0.00 H ATOM 958 N GLN A 70 1.726 30.113 -20.948 1.00 44.86 N ATOM 959 CA GLN A 70 0.901 29.500 -19.908 1.00 46.39 C ATOM 960 C GLN A 70 1.749 29.040 -18.738 1.00 48.48 C ATOM 961 O GLN A 70 2.743 28.345 -18.916 1.00 50.60 O ATOM 962 CB GLN A 70 0.141 28.304 -20.466 1.00 45.15 C ATOM 963 CG GLN A 70 -0.641 28.596 -21.720 1.00 45.19 C ATOM 964 CD GLN A 70 -1.328 27.363 -22.254 1.00 56.77 C ATOM 965 OE1 GLN A 70 -1.444 26.345 -21.410 1.00 64.29 O ATOM 966 NE2 GLN A 70 -1.726 27.311 -23.420 1.00 64.88 N ATOM 967 HA GLN A 70 0.196 30.256 -19.562 1.00 0.00 H ATOM 968 HB2 GLN A 70 0.860 27.516 -20.688 1.00 0.00 H ATOM 969 HB3 GLN A 70 -0.555 27.955 -19.703 1.00 0.00 H ATOM 970 HG2 GLN A 70 -1.395 29.352 -21.498 1.00 0.00 H ATOM 971 HG3 GLN A 70 0.041 28.977 -22.480 1.00 0.00 H ATOM 972 HE22 GLN A 70 -1.613 28.135 -24.045 1.00 0.00 H ATOM 973 HE21 GLN A 70 -2.174 26.444 -23.778 1.00 0.00 H ATOM 974 H GLN A 70 2.408 29.522 -21.465 1.00 0.00 H ATOM 975 N LEU A 71 1.353 29.444 -17.539 1.00 44.00 N ATOM 976 CA LEU A 71 1.993 29.006 -16.311 1.00 41.65 C ATOM 977 C LEU A 71 0.865 28.493 -15.415 1.00 43.90 C ATOM 978 O LEU A 71 -0.306 28.665 -15.750 1.00 43.86 O ATOM 979 CB LEU A 71 2.710 30.182 -15.641 1.00 42.18 C ATOM 980 CG LEU A 71 3.761 30.869 -16.523 1.00 51.96 C ATOM 981 CD1 LEU A 71 4.382 32.057 -15.820 1.00 46.62 C ATOM 982 CD2 LEU A 71 4.833 29.874 -16.909 1.00 60.81 C ATOM 983 HA LEU A 71 2.740 28.234 -16.498 1.00 0.00 H ATOM 984 HB2 LEU A 71 1.962 30.924 -15.362 1.00 0.00 H ATOM 985 HB3 LEU A 71 3.206 29.813 -14.744 1.00 0.00 H ATOM 986 HG LEU A 71 3.264 31.236 -17.421 1.00 0.00 H ATOM 987 HD21 LEU A 71 5.312 29.490 -16.008 1.00 0.00 H ATOM 988 HD22 LEU A 71 4.380 29.050 -17.461 1.00 0.00 H ATOM 989 HD23 LEU A 71 5.576 30.367 -17.535 1.00 0.00 H ATOM 990 HD11 LEU A 71 3.605 32.782 -15.579 1.00 0.00 H ATOM 991 HD12 LEU A 71 4.865 31.722 -14.902 1.00 0.00 H ATOM 992 HD13 LEU A 71 5.121 32.519 -16.474 1.00 0.00 H ATOM 993 H LEU A 71 0.550 30.102 -17.475 1.00 0.00 H ATOM 994 N THR A 72 1.201 27.706 -14.401 1.00 47.07 N ATOM 995 CA THR A 72 0.170 27.169 -13.523 1.00 47.03 C ATOM 996 C THR A 72 0.448 27.513 -12.080 1.00 42.32 C ATOM 997 O THR A 72 1.601 27.685 -11.674 1.00 43.34 O ATOM 998 CB THR A 72 -0.020 25.625 -13.650 1.00 50.78 C ATOM 999 OG1 THR A 72 1.111 24.953 -13.086 1.00 56.47 O ATOM 1000 CG2 THR A 72 -0.203 25.200 -15.098 1.00 48.35 C ATOM 1001 HA THR A 72 -0.756 27.641 -13.850 1.00 0.00 H ATOM 1002 HB THR A 72 -0.923 25.351 -13.105 1.00 0.00 H ATOM 1003 HG1 THR A 72 1.195 25.197 -12.130 1.00 0.00 H ATOM 1004 HG23 THR A 72 -1.066 25.716 -15.520 1.00 0.00 H ATOM 1005 HG21 THR A 72 0.690 25.458 -15.667 1.00 0.00 H ATOM 1006 HG22 THR A 72 -0.365 24.123 -15.142 1.00 0.00 H ATOM 1007 H THR A 72 2.200 27.472 -14.233 1.00 0.00 H ATOM 1008 N ALA A 73 -0.635 27.684 -11.326 1.00 40.71 N ATOM 1009 CA ALA A 73 -0.558 27.922 -9.903 1.00 33.71 C ATOM 1010 C ALA A 73 -1.803 27.318 -9.253 1.00 34.71 C ATOM 1011 O ALA A 73 -2.619 26.676 -9.923 1.00 39.57 O ATOM 1012 CB ALA A 73 -0.474 29.409 -9.620 1.00 40.13 C ATOM 1013 HA ALA A 73 0.338 27.457 -9.491 1.00 0.00 H ATOM 1014 HB1 ALA A 73 0.416 29.819 -10.098 1.00 0.00 H ATOM 1015 HB2 ALA A 73 -1.361 29.904 -10.016 1.00 0.00 H ATOM 1016 HB3 ALA A 73 -0.417 29.570 -8.543 1.00 0.00 H ATOM 1017 H ALA A 73 -1.571 27.645 -11.777 1.00 0.00 H ATOM 1018 N THR A 74 -1.885 27.442 -7.941 1.00 34.21 N ATOM 1019 CA THR A 74 -3.017 26.924 -7.198 1.00 38.20 C ATOM 1020 C THR A 74 -3.891 28.085 -6.751 1.00 39.19 C ATOM 1021 O THR A 74 -3.389 29.165 -6.450 1.00 38.22 O ATOM 1022 CB THR A 74 -2.538 26.155 -5.972 1.00 39.93 C ATOM 1023 OG1 THR A 74 -1.712 25.074 -6.408 1.00 39.22 O ATOM 1024 CG2 THR A 74 -3.737 25.599 -5.136 1.00 31.14 C ATOM 1025 HA THR A 74 -3.586 26.250 -7.838 1.00 0.00 H ATOM 1026 HB THR A 74 -1.977 26.834 -5.330 1.00 0.00 H ATOM 1027 HG1 THR A 74 -1.393 24.565 -5.621 1.00 0.00 H ATOM 1028 HG23 THR A 74 -4.364 26.428 -4.806 1.00 0.00 H ATOM 1029 HG21 THR A 74 -4.325 24.921 -5.754 1.00 0.00 H ATOM 1030 HG22 THR A 74 -3.355 25.063 -4.267 1.00 0.00 H ATOM 1031 H THR A 74 -1.119 27.923 -7.428 1.00 0.00 H ATOM 1032 N VAL A 75 -5.202 27.870 -6.778 1.00 39.25 N ATOM 1033 CA VAL A 75 -6.168 28.839 -6.278 1.00 36.69 C ATOM 1034 C VAL A 75 -7.136 28.115 -5.330 1.00 37.66 C ATOM 1035 O VAL A 75 -7.596 27.013 -5.630 1.00 40.26 O ATOM 1036 CB VAL A 75 -6.954 29.468 -7.447 1.00 39.85 C ATOM 1037 CG1 VAL A 75 -7.850 28.414 -8.109 1.00 27.47 C ATOM 1038 CG2 VAL A 75 -7.761 30.696 -6.969 1.00 34.45 C ATOM 1039 HA VAL A 75 -5.647 29.636 -5.749 1.00 0.00 H ATOM 1040 HB VAL A 75 -6.248 29.823 -8.198 1.00 0.00 H ATOM 1041 HG11 VAL A 75 -7.232 27.601 -8.490 1.00 0.00 H ATOM 1042 HG12 VAL A 75 -8.554 28.024 -7.374 1.00 0.00 H ATOM 1043 HG13 VAL A 75 -8.399 28.871 -8.932 1.00 0.00 H ATOM 1044 HG21 VAL A 75 -8.466 30.388 -6.197 1.00 0.00 H ATOM 1045 HG22 VAL A 75 -7.078 31.442 -6.563 1.00 0.00 H ATOM 1046 HG23 VAL A 75 -8.306 31.121 -7.812 1.00 0.00 H ATOM 1047 H VAL A 75 -5.553 26.974 -7.172 1.00 0.00 H ATOM 1048 N THR A 76 -7.349 28.693 -4.152 1.00 34.63 N ATOM 1049 CA THR A 76 -8.288 28.171 -3.162 1.00 39.48 C ATOM 1050 C THR A 76 -9.323 29.247 -2.877 1.00 40.66 C ATOM 1051 O THR A 76 -8.981 30.423 -2.743 1.00 40.78 O ATOM 1052 CB THR A 76 -7.572 27.843 -1.831 1.00 40.44 C ATOM 1053 OG1 THR A 76 -6.363 27.123 -2.111 1.00 41.94 O ATOM 1054 CG2 THR A 76 -8.472 26.983 -0.928 1.00 37.30 C ATOM 1055 HA THR A 76 -8.741 27.262 -3.557 1.00 0.00 H ATOM 1056 HB THR A 76 -7.346 28.777 -1.316 1.00 0.00 H ATOM 1057 HG1 THR A 76 -6.583 26.283 -2.586 1.00 0.00 H ATOM 1058 HG23 THR A 76 -9.392 27.526 -0.712 1.00 0.00 H ATOM 1059 HG21 THR A 76 -8.710 26.049 -1.438 1.00 0.00 H ATOM 1060 HG22 THR A 76 -7.949 26.767 0.004 1.00 0.00 H ATOM 1061 H THR A 76 -6.821 29.560 -3.924 1.00 0.00 H ATOM 1062 N VAL A 77 -10.589 28.849 -2.861 1.00 37.86 N ATOM 1063 CA VAL A 77 -11.701 29.789 -2.743 1.00 37.60 C ATOM 1064 C VAL A 77 -12.493 29.623 -1.449 1.00 36.29 C ATOM 1065 O VAL A 77 -12.942 28.525 -1.126 1.00 36.82 O ATOM 1066 CB VAL A 77 -12.649 29.683 -3.960 1.00 35.01 C ATOM 1067 CG1 VAL A 77 -11.977 30.271 -5.216 1.00 30.74 C ATOM 1068 CG2 VAL A 77 -13.021 28.244 -4.211 1.00 36.56 C ATOM 1069 HA VAL A 77 -11.252 30.782 -2.719 1.00 0.00 H ATOM 1070 HB VAL A 77 -13.553 30.251 -3.741 1.00 0.00 H ATOM 1071 HG11 VAL A 77 -11.738 31.320 -5.041 1.00 0.00 H ATOM 1072 HG12 VAL A 77 -11.061 29.719 -5.429 1.00 0.00 H ATOM 1073 HG13 VAL A 77 -12.658 30.188 -6.063 1.00 0.00 H ATOM 1074 HG21 VAL A 77 -12.119 27.666 -4.411 1.00 0.00 H ATOM 1075 HG22 VAL A 77 -13.524 27.841 -3.332 1.00 0.00 H ATOM 1076 HG23 VAL A 77 -13.689 28.187 -5.071 1.00 0.00 H ATOM 1077 H VAL A 77 -10.797 27.833 -2.935 1.00 0.00 H ATOM 1078 N ASN A 78 -12.649 30.724 -0.714 1.00 39.64 N ATOM 1079 CA ASN A 78 -13.470 30.770 0.499 1.00 43.12 C ATOM 1080 C ASN A 78 -14.194 32.124 0.623 1.00 35.33 C ATOM 1081 O ASN A 78 -13.553 33.164 0.618 1.00 37.99 O ATOM 1082 CB ASN A 78 -12.595 30.536 1.744 1.00 40.74 C ATOM 1083 CG ASN A 78 -11.908 29.168 1.739 1.00 52.74 C ATOM 1084 OD1 ASN A 78 -12.627 28.138 2.179 1.00 55.18 O ATOM 1085 ND2 ASN A 78 -10.726 29.058 1.414 1.00 40.33 N ATOM 1086 HA ASN A 78 -14.218 29.980 0.429 1.00 0.00 H ATOM 1087 HB2 ASN A 78 -11.829 31.310 1.782 1.00 0.00 H ATOM 1088 HB3 ASN A 78 -13.225 30.606 2.631 1.00 0.00 H ATOM 1089 HD22 ASN A 78 -10.200 29.889 1.075 1.00 0.00 H ATOM 1090 HD21 ASN A 78 -10.253 28.134 1.478 1.00 0.00 H ATOM 1091 H ASN A 78 -12.164 31.593 -1.016 1.00 0.00 H ATOM 1092 N GLY A 79 -15.508 32.107 0.827 1.00 33.66 N ATOM 1093 CA GLY A 79 -16.258 33.367 0.935 1.00 33.02 C ATOM 1094 C GLY A 79 -15.918 34.213 -0.277 1.00 31.10 C ATOM 1095 O GLY A 79 -15.783 33.680 -1.366 1.00 30.33 O ATOM 1096 HA3 GLY A 79 -15.972 33.892 1.846 1.00 0.00 H ATOM 1097 HA2 GLY A 79 -17.328 33.161 0.956 1.00 0.00 H ATOM 1098 H GLY A 79 -16.007 31.199 0.911 1.00 0.00 H ATOM 1099 N ASP A 80 -15.560 35.472 -0.057 1.00 32.88 N ATOM 1100 CA ASP A 80 -15.147 36.339 -1.157 1.00 33.50 C ATOM 1101 C ASP A 80 -13.645 36.361 -1.431 1.00 38.78 C ATOM 1102 O ASP A 80 -13.162 37.222 -2.171 1.00 34.65 O ATOM 1103 CB ASP A 80 -15.677 37.770 -0.956 1.00 35.94 C ATOM 1104 CG ASP A 80 -15.118 38.436 0.295 1.00 43.05 C ATOM 1105 OD1 ASP A 80 -14.401 37.760 1.060 1.00 49.54 O ATOM 1106 OD2 ASP A 80 -15.427 39.628 0.536 1.00 52.23 O ATOM 1107 HA ASP A 80 -15.597 35.897 -2.046 1.00 0.00 H ATOM 1108 HB2 ASP A 80 -15.400 38.369 -1.823 1.00 0.00 H ATOM 1109 HB3 ASP A 80 -16.763 37.731 -0.875 1.00 0.00 H ATOM 1110 H ASP A 80 -15.574 35.847 0.913 1.00 0.00 H ATOM 1111 N LYS A 81 -12.923 35.366 -0.924 1.00 35.13 N ATOM 1112 CA LYS A 81 -11.467 35.322 -1.087 1.00 39.68 C ATOM 1113 C LYS A 81 -10.983 34.340 -2.154 1.00 36.14 C ATOM 1114 O LYS A 81 -11.350 33.165 -2.149 1.00 37.80 O ATOM 1115 CB LYS A 81 -10.777 34.990 0.238 1.00 42.09 C ATOM 1116 CG LYS A 81 -11.109 35.935 1.370 1.00 44.41 C ATOM 1117 CD LYS A 81 -10.699 37.352 1.037 1.00 45.56 C ATOM 1118 CE LYS A 81 -11.246 38.309 2.102 1.00 51.43 C ATOM 1119 NZ LYS A 81 -10.581 39.637 2.006 1.00 45.44 N ATOM 1120 HA LYS A 81 -11.195 36.322 -1.424 1.00 0.00 H ATOM 1121 HB2 LYS A 81 -11.075 33.984 0.535 1.00 0.00 H ATOM 1122 HB3 LYS A 81 -9.699 35.016 0.077 1.00 0.00 H ATOM 1123 HG2 LYS A 81 -12.183 35.909 1.552 1.00 0.00 H ATOM 1124 HG3 LYS A 81 -10.582 35.614 2.268 1.00 0.00 H ATOM 1125 HD2 LYS A 81 -9.611 37.419 1.013 1.00 0.00 H ATOM 1126 HD3 LYS A 81 -11.101 37.626 0.062 1.00 0.00 H ATOM 1127 HE2 LYS A 81 -11.063 37.887 3.090 1.00 0.00 H ATOM 1128 HE3 LYS A 81 -12.319 38.434 1.954 1.00 0.00 H ATOM 1129 HZ1 LYS A 81 -9.557 39.522 2.150 1.00 0.00 H ATOM 1130 HZ2 LYS A 81 -10.756 40.044 1.065 1.00 0.00 H ATOM 1131 HZ3 LYS A 81 -10.966 40.270 2.736 1.00 0.00 H ATOM 1132 H LYS A 81 -13.401 34.604 -0.402 1.00 0.00 H ATOM 1133 N ILE A 82 -10.160 34.846 -3.068 1.00 33.70 N ATOM 1134 CA ILE A 82 -9.423 34.017 -4.024 1.00 42.82 C ATOM 1135 C ILE A 82 -7.964 34.031 -3.587 1.00 43.85 C ATOM 1136 O ILE A 82 -7.320 35.084 -3.577 1.00 42.66 O ATOM 1137 CB ILE A 82 -9.513 34.577 -5.468 1.00 42.56 C ATOM 1138 CG1 ILE A 82 -10.963 34.541 -5.969 1.00 32.43 C ATOM 1139 CG2 ILE A 82 -8.601 33.780 -6.436 1.00 36.68 C ATOM 1140 CD1 ILE A 82 -11.177 35.322 -7.265 1.00 40.87 C ATOM 1141 HA ILE A 82 -9.848 33.013 -4.034 1.00 0.00 H ATOM 1142 HB ILE A 82 -9.169 35.611 -5.445 1.00 0.00 H ATOM 1143 HG12 ILE A 82 -11.244 33.502 -6.141 1.00 0.00 H ATOM 1144 HG13 ILE A 82 -11.606 34.967 -5.199 1.00 0.00 H ATOM 1145 HD11 ILE A 82 -10.911 36.367 -7.106 1.00 0.00 H ATOM 1146 HD12 ILE A 82 -10.548 34.901 -8.050 1.00 0.00 H ATOM 1147 HD13 ILE A 82 -12.224 35.253 -7.560 1.00 0.00 H ATOM 1148 HG21 ILE A 82 -7.567 33.850 -6.099 1.00 0.00 H ATOM 1149 HG22 ILE A 82 -8.911 32.735 -6.448 1.00 0.00 H ATOM 1150 HG23 ILE A 82 -8.686 34.197 -7.440 1.00 0.00 H ATOM 1151 H ILE A 82 -10.034 35.878 -3.105 1.00 0.00 H ATOM 1152 N GLU A 83 -7.509 32.901 -3.057 1.00 39.83 N ATOM 1153 CA GLU A 83 -6.157 32.803 -2.514 1.00 42.52 C ATOM 1154 C GLU A 83 -5.254 32.051 -3.470 1.00 40.29 C ATOM 1155 O GLU A 83 -5.509 30.892 -3.790 1.00 35.49 O ATOM 1156 CB GLU A 83 -6.176 32.098 -1.157 1.00 47.25 C ATOM 1157 CG GLU A 83 -4.791 31.933 -0.546 1.00 57.39 C ATOM 1158 CD GLU A 83 -4.163 33.259 -0.149 1.00 59.53 C ATOM 1159 OE1 GLU A 83 -4.902 34.145 0.324 1.00 70.20 O ATOM 1160 OE2 GLU A 83 -2.929 33.400 -0.278 1.00 66.17 O ATOM 1161 HA GLU A 83 -5.769 33.813 -2.383 1.00 0.00 H ATOM 1162 HB2 GLU A 83 -6.790 32.682 -0.471 1.00 0.00 H ATOM 1163 HB3 GLU A 83 -6.618 31.110 -1.286 1.00 0.00 H ATOM 1164 HG2 GLU A 83 -4.874 31.306 0.342 1.00 0.00 H ATOM 1165 HG3 GLU A 83 -4.144 31.445 -1.275 1.00 0.00 H ATOM 1166 H GLU A 83 -8.130 32.067 -3.028 1.00 0.00 H ATOM 1167 N VAL A 84 -4.223 32.731 -3.965 1.00 39.48 N ATOM 1168 CA VAL A 84 -3.360 32.164 -4.977 1.00 37.83 C ATOM 1169 C VAL A 84 -1.987 31.840 -4.383 1.00 42.56 C ATOM 1170 O VAL A 84 -1.482 32.585 -3.532 1.00 37.98 O ATOM 1171 CB VAL A 84 -3.198 33.103 -6.202 1.00 44.78 C ATOM 1172 CG1 VAL A 84 -2.054 32.632 -7.082 1.00 43.70 C ATOM 1173 CG2 VAL A 84 -4.484 33.157 -7.000 1.00 38.99 C ATOM 1174 HA VAL A 84 -3.833 31.246 -5.326 1.00 0.00 H ATOM 1175 HB VAL A 84 -2.970 34.106 -5.840 1.00 0.00 H ATOM 1176 HG11 VAL A 84 -1.129 32.636 -6.506 1.00 0.00 H ATOM 1177 HG12 VAL A 84 -2.260 31.621 -7.434 1.00 0.00 H ATOM 1178 HG13 VAL A 84 -1.955 33.302 -7.936 1.00 0.00 H ATOM 1179 HG21 VAL A 84 -4.735 32.156 -7.350 1.00 0.00 H ATOM 1180 HG22 VAL A 84 -5.287 33.534 -6.367 1.00 0.00 H ATOM 1181 HG23 VAL A 84 -4.352 33.820 -7.855 1.00 0.00 H ATOM 1182 H VAL A 84 -4.034 33.692 -3.616 1.00 0.00 H ATOM 1183 N THR A 85 -1.520 30.625 -4.666 1.00 43.21 N ATOM 1184 CA THR A 85 -0.211 30.154 -4.201 1.00 45.03 C ATOM 1185 C THR A 85 0.588 29.594 -5.375 1.00 40.39 C ATOM 1186 O THR A 85 0.058 28.846 -6.200 1.00 41.54 O ATOM 1187 CB THR A 85 -0.357 29.056 -3.101 1.00 44.23 C ATOM 1188 OG1 THR A 85 -1.437 28.182 -3.431 1.00 47.04 O ATOM 1189 CG2 THR A 85 -0.657 29.669 -1.783 1.00 39.08 C ATOM 1190 HA THR A 85 0.314 31.005 -3.768 1.00 0.00 H ATOM 1191 HB THR A 85 0.584 28.508 -3.049 1.00 0.00 H ATOM 1192 HG1 THR A 85 -1.256 27.750 -4.303 1.00 0.00 H ATOM 1193 HG23 THR A 85 0.153 30.343 -1.505 1.00 0.00 H ATOM 1194 HG21 THR A 85 -1.591 30.228 -1.848 1.00 0.00 H ATOM 1195 HG22 THR A 85 -0.753 28.885 -1.032 1.00 0.00 H ATOM 1196 H THR A 85 -2.106 29.985 -5.239 1.00 0.00 H ATOM 1197 N GLY A 86 1.841 30.013 -5.501 1.00 43.48 N ATOM 1198 CA GLY A 86 2.707 29.470 -6.548 1.00 44.89 C ATOM 1199 C GLY A 86 2.655 30.179 -7.888 1.00 49.33 C ATOM 1200 O GLY A 86 3.041 29.610 -8.918 1.00 45.26 O ATOM 1201 HA3 GLY A 86 2.424 28.430 -6.709 1.00 0.00 H ATOM 1202 HA2 GLY A 86 3.735 29.513 -6.187 1.00 0.00 H ATOM 1203 H GLY A 86 2.211 30.734 -4.849 1.00 0.00 H ATOM 1204 N ALA A 87 2.286 31.456 -7.866 1.00 49.88 N ATOM 1205 CA ALA A 87 2.194 32.245 -9.086 1.00 53.69 C ATOM 1206 C ALA A 87 3.234 33.367 -9.099 1.00 60.26 C ATOM 1207 O ALA A 87 3.169 34.282 -9.924 1.00 68.79 O ATOM 1208 CB ALA A 87 0.778 32.808 -9.250 1.00 48.61 C ATOM 1209 HA ALA A 87 2.406 31.591 -9.932 1.00 0.00 H ATOM 1210 HB1 ALA A 87 0.065 31.985 -9.303 1.00 0.00 H ATOM 1211 HB2 ALA A 87 0.540 33.442 -8.396 1.00 0.00 H ATOM 1212 HB3 ALA A 87 0.726 33.395 -10.167 1.00 0.00 H ATOM 1213 H ALA A 87 2.057 31.902 -6.955 1.00 0.00 H ATOM 1214 N GLY A 88 4.191 33.289 -8.180 1.00 66.35 N ATOM 1215 CA GLY A 88 5.278 34.248 -8.128 1.00 71.35 C ATOM 1216 C GLY A 88 4.846 35.585 -7.560 1.00 75.94 C ATOM 1217 O GLY A 88 3.969 35.651 -6.699 1.00 73.28 O ATOM 1218 HA3 GLY A 88 5.656 34.403 -9.138 1.00 0.00 H ATOM 1219 HA2 GLY A 88 6.073 33.842 -7.502 1.00 0.00 H ATOM 1220 H GLY A 88 4.160 32.520 -7.480 1.00 0.00 H ATOM 1221 N GLN A 89 5.465 36.657 -8.046 1.00 79.44 N ATOM 1222 CA GLN A 89 5.497 37.919 -7.317 1.00 81.71 C ATOM 1223 C GLN A 89 4.413 38.870 -7.814 1.00 83.05 C ATOM 1224 O GLN A 89 4.442 40.066 -7.524 1.00 89.52 O ATOM 1225 CB GLN A 89 6.872 38.577 -7.444 1.00 82.60 C ATOM 1226 CG GLN A 89 7.816 38.269 -6.293 1.00 85.36 C ATOM 1227 CD GLN A 89 7.223 38.618 -4.943 1.00 90.86 C ATOM 1228 OE1 GLN A 89 6.617 39.677 -4.773 1.00 82.95 O ATOM 1229 NE2 GLN A 89 7.394 37.728 -3.972 1.00 85.06 N ATOM 1230 HA GLN A 89 5.305 37.702 -6.266 1.00 0.00 H ATOM 1231 HB2 GLN A 89 7.334 38.230 -8.368 1.00 0.00 H ATOM 1232 HB3 GLN A 89 6.732 39.657 -7.493 1.00 0.00 H ATOM 1233 HG2 GLN A 89 8.049 37.204 -6.308 1.00 0.00 H ATOM 1234 HG3 GLN A 89 8.733 38.842 -6.430 1.00 0.00 H ATOM 1235 HE22 GLN A 89 7.913 36.846 -4.160 1.00 0.00 H ATOM 1236 HE21 GLN A 89 7.009 37.913 -3.024 1.00 0.00 H ATOM 1237 H GLN A 89 5.938 36.593 -8.970 1.00 0.00 H ATOM 1238 N ASP A 90 3.458 38.330 -8.564 1.00 78.85 N ATOM 1239 CA ASP A 90 2.331 39.116 -9.053 1.00 74.38 C ATOM 1240 C ASP A 90 1.013 38.605 -8.481 1.00 71.31 C ATOM 1241 O ASP A 90 0.399 39.255 -7.635 1.00 64.20 O ATOM 1242 CB ASP A 90 2.285 39.093 -10.582 1.00 74.00 C ATOM 1243 CG ASP A 90 2.815 37.797 -11.161 1.00 80.81 C ATOM 1244 OD1 ASP A 90 2.756 36.763 -10.462 1.00 88.57 O ATOM 1245 OD2 ASP A 90 3.291 37.811 -12.316 1.00 79.63 O ATOM 1246 HA ASP A 90 2.472 40.144 -8.719 1.00 0.00 H ATOM 1247 HB2 ASP A 90 1.251 39.222 -10.903 1.00 0.00 H ATOM 1248 HB3 ASP A 90 2.888 39.918 -10.962 1.00 0.00 H ATOM 1249 H ASP A 90 3.516 37.321 -8.809 1.00 0.00 H ATOM 1250 N LEU A 91 0.585 37.437 -8.948 1.00 62.34 N ATOM 1251 CA LEU A 91 -0.756 36.951 -8.675 1.00 55.80 C ATOM 1252 C LEU A 91 -0.905 36.265 -7.316 1.00 51.40 C ATOM 1253 O LEU A 91 -2.022 36.105 -6.816 1.00 45.18 O ATOM 1254 CB LEU A 91 -1.194 36.028 -9.812 1.00 55.50 C ATOM 1255 CG LEU A 91 -2.671 35.868 -10.149 1.00 59.87 C ATOM 1256 CD1 LEU A 91 -3.343 37.229 -10.340 1.00 55.80 C ATOM 1257 CD2 LEU A 91 -2.781 35.014 -11.408 1.00 55.48 C ATOM 1258 HA LEU A 91 -1.410 37.821 -8.622 1.00 0.00 H ATOM 1259 HB2 LEU A 91 -0.704 36.390 -10.716 1.00 0.00 H ATOM 1260 HB3 LEU A 91 -0.818 35.034 -9.570 1.00 0.00 H ATOM 1261 HG LEU A 91 -3.189 35.377 -9.325 1.00 0.00 H ATOM 1262 HD21 LEU A 91 -2.260 35.509 -12.228 1.00 0.00 H ATOM 1263 HD22 LEU A 91 -2.330 34.039 -11.225 1.00 0.00 H ATOM 1264 HD23 LEU A 91 -3.832 34.886 -11.668 1.00 0.00 H ATOM 1265 HD11 LEU A 91 -3.255 37.808 -9.421 1.00 0.00 H ATOM 1266 HD12 LEU A 91 -2.855 37.763 -11.155 1.00 0.00 H ATOM 1267 HD13 LEU A 91 -4.396 37.082 -10.579 1.00 0.00 H ATOM 1268 H LEU A 91 1.227 36.856 -9.524 1.00 0.00 H ATOM 1269 N SER A 92 0.215 35.920 -6.683 1.00 50.79 N ATOM 1270 CA SER A 92 0.163 35.177 -5.421 1.00 45.92 C ATOM 1271 C SER A 92 -0.337 36.025 -4.264 1.00 40.10 C ATOM 1272 O SER A 92 -0.100 37.231 -4.207 1.00 43.22 O ATOM 1273 CB SER A 92 1.520 34.541 -5.087 1.00 49.13 C ATOM 1274 OG SER A 92 1.861 33.563 -6.060 1.00 48.23 O ATOM 1275 HA SER A 92 -0.563 34.377 -5.566 1.00 0.00 H ATOM 1276 HB2 SER A 92 1.464 34.068 -4.106 1.00 0.00 H ATOM 1277 HB3 SER A 92 2.286 35.316 -5.072 1.00 0.00 H ATOM 1278 HG SER A 92 2.737 33.163 -5.831 1.00 0.00 H ATOM 1279 H SER A 92 1.136 36.181 -7.089 1.00 0.00 H ATOM 1280 N GLY A 93 -1.096 35.402 -3.368 1.00 39.04 N ATOM 1281 CA GLY A 93 -1.666 36.114 -2.245 1.00 34.82 C ATOM 1282 C GLY A 93 -3.180 36.206 -2.361 1.00 38.08 C ATOM 1283 O GLY A 93 -3.786 35.583 -3.239 1.00 39.62 O ATOM 1284 HA3 GLY A 93 -1.250 37.121 -2.214 1.00 0.00 H ATOM 1285 HA2 GLY A 93 -1.411 35.589 -1.325 1.00 0.00 H ATOM 1286 H GLY A 93 -1.283 34.385 -3.476 1.00 0.00 H ATOM 1287 N THR A 94 -3.772 37.086 -1.569 1.00 35.89 N ATOM 1288 CA THR A 94 -5.224 37.117 -1.439 1.00 41.48 C ATOM 1289 C THR A 94 -5.890 38.170 -2.331 1.00 39.25 C ATOM 1290 O THR A 94 -5.663 39.368 -2.189 1.00 38.57 O ATOM 1291 CB THR A 94 -5.637 37.329 0.026 1.00 43.63 C ATOM 1292 OG1 THR A 94 -4.943 36.384 0.849 1.00 49.98 O ATOM 1293 CG2 THR A 94 -7.144 37.133 0.199 1.00 42.20 C ATOM 1294 HA THR A 94 -5.578 36.144 -1.780 1.00 0.00 H ATOM 1295 HB THR A 94 -5.382 38.348 0.318 1.00 0.00 H ATOM 1296 HG1 THR A 94 -5.179 35.465 0.565 1.00 0.00 H ATOM 1297 HG23 THR A 94 -7.676 37.850 -0.426 1.00 0.00 H ATOM 1298 HG21 THR A 94 -7.414 36.120 -0.098 1.00 0.00 H ATOM 1299 HG22 THR A 94 -7.412 37.290 1.244 1.00 0.00 H ATOM 1300 H THR A 94 -3.194 37.764 -1.033 1.00 0.00 H ATOM 1301 N THR A 95 -6.709 37.704 -3.260 1.00 39.55 N ATOM 1302 CA THR A 95 -7.535 38.593 -4.065 1.00 38.76 C ATOM 1303 C THR A 95 -8.969 38.549 -3.517 1.00 38.17 C ATOM 1304 O THR A 95 -9.498 37.474 -3.254 1.00 36.52 O ATOM 1305 CB THR A 95 -7.528 38.106 -5.516 1.00 38.54 C ATOM 1306 OG1 THR A 95 -6.243 38.347 -6.097 1.00 33.78 O ATOM 1307 CG2 THR A 95 -8.613 38.796 -6.333 1.00 38.07 C ATOM 1308 HA THR A 95 -7.150 39.612 -4.024 1.00 0.00 H ATOM 1309 HB THR A 95 -7.735 37.036 -5.522 1.00 0.00 H ATOM 1310 HG1 THR A 95 -5.553 37.859 -5.582 1.00 0.00 H ATOM 1311 HG23 THR A 95 -9.585 38.604 -5.879 1.00 0.00 H ATOM 1312 HG21 THR A 95 -8.425 39.869 -6.351 1.00 0.00 H ATOM 1313 HG22 THR A 95 -8.602 38.407 -7.351 1.00 0.00 H ATOM 1314 H THR A 95 -6.764 36.678 -3.419 1.00 0.00 H ATOM 1315 N THR A 96 -9.604 39.711 -3.353 1.00 32.58 N ATOM 1316 CA THR A 96 -10.963 39.765 -2.818 1.00 32.38 C ATOM 1317 C THR A 96 -11.925 40.182 -3.931 1.00 31.66 C ATOM 1318 O THR A 96 -11.696 41.174 -4.611 1.00 27.95 O ATOM 1319 CB THR A 96 -11.088 40.796 -1.652 1.00 33.23 C ATOM 1320 OG1 THR A 96 -10.108 40.508 -0.656 1.00 46.30 O ATOM 1321 CG2 THR A 96 -12.484 40.760 -1.005 1.00 27.74 C ATOM 1322 HA THR A 96 -11.207 38.774 -2.434 1.00 0.00 H ATOM 1323 HB THR A 96 -10.931 41.791 -2.070 1.00 0.00 H ATOM 1324 HG1 THR A 96 -9.205 40.569 -1.056 1.00 0.00 H ATOM 1325 HG23 THR A 96 -13.239 40.979 -1.760 1.00 0.00 H ATOM 1326 HG21 THR A 96 -12.664 39.770 -0.587 1.00 0.00 H ATOM 1327 HG22 THR A 96 -12.535 41.506 -0.212 1.00 0.00 H ATOM 1328 H THR A 96 -9.122 40.596 -3.611 1.00 0.00 H ATOM 1329 N VAL A 97 -13.037 39.472 -4.045 1.00 26.46 N ATOM 1330 CA VAL A 97 -14.045 39.830 -5.037 1.00 29.63 C ATOM 1331 C VAL A 97 -14.946 40.933 -4.481 1.00 28.82 C ATOM 1332 O VAL A 97 -15.662 40.703 -3.523 1.00 28.91 O ATOM 1333 CB VAL A 97 -14.888 38.623 -5.450 1.00 28.13 C ATOM 1334 CG1 VAL A 97 -15.766 38.987 -6.643 1.00 33.36 C ATOM 1335 CG2 VAL A 97 -13.983 37.424 -5.780 1.00 28.26 C ATOM 1336 HA VAL A 97 -13.528 40.190 -5.926 1.00 0.00 H ATOM 1337 HB VAL A 97 -15.533 38.339 -4.619 1.00 0.00 H ATOM 1338 HG11 VAL A 97 -16.426 39.810 -6.369 1.00 0.00 H ATOM 1339 HG12 VAL A 97 -15.134 39.288 -7.479 1.00 0.00 H ATOM 1340 HG13 VAL A 97 -16.363 38.122 -6.931 1.00 0.00 H ATOM 1341 HG21 VAL A 97 -13.316 37.689 -6.600 1.00 0.00 H ATOM 1342 HG22 VAL A 97 -13.394 37.162 -4.901 1.00 0.00 H ATOM 1343 HG23 VAL A 97 -14.600 36.574 -6.072 1.00 0.00 H ATOM 1344 H VAL A 97 -13.193 38.653 -3.423 1.00 0.00 H ATOM 1345 N LEU A 98 -14.849 42.140 -5.036 1.00 26.84 N ATOM 1346 CA LEU A 98 -15.665 43.259 -4.553 1.00 31.73 C ATOM 1347 C LEU A 98 -17.003 43.245 -5.269 1.00 28.88 C ATOM 1348 O LEU A 98 -17.980 43.779 -4.777 1.00 27.82 O ATOM 1349 CB LEU A 98 -14.950 44.585 -4.813 1.00 29.39 C ATOM 1350 CG LEU A 98 -13.544 44.662 -4.211 1.00 34.54 C ATOM 1351 CD1 LEU A 98 -12.980 46.023 -4.523 1.00 31.12 C ATOM 1352 CD2 LEU A 98 -13.614 44.404 -2.693 1.00 29.86 C ATOM 1353 HA LEU A 98 -15.822 43.154 -3.480 1.00 0.00 H ATOM 1354 HB2 LEU A 98 -14.870 44.726 -5.891 1.00 0.00 H ATOM 1355 HB3 LEU A 98 -15.551 45.388 -4.386 1.00 0.00 H ATOM 1356 HG LEU A 98 -12.891 43.901 -4.638 1.00 0.00 H ATOM 1357 HD21 LEU A 98 -14.249 45.157 -2.227 1.00 0.00 H ATOM 1358 HD22 LEU A 98 -14.031 43.413 -2.513 1.00 0.00 H ATOM 1359 HD23 LEU A 98 -12.611 44.460 -2.270 1.00 0.00 H ATOM 1360 HD11 LEU A 98 -12.936 46.158 -5.604 1.00 0.00 H ATOM 1361 HD12 LEU A 98 -13.620 46.789 -4.086 1.00 0.00 H ATOM 1362 HD13 LEU A 98 -11.977 46.104 -4.104 1.00 0.00 H ATOM 1363 H LEU A 98 -14.186 42.291 -5.823 1.00 0.00 H ATOM 1364 N PHE A 99 -16.995 42.747 -6.500 1.00 27.55 N ATOM 1365 CA PHE A 99 -18.211 42.616 -7.282 1.00 30.47 C ATOM 1366 C PHE A 99 -18.007 41.647 -8.437 1.00 29.48 C ATOM 1367 O PHE A 99 -16.926 41.547 -8.988 1.00 29.54 O ATOM 1368 CB PHE A 99 -18.673 43.984 -7.807 1.00 30.48 C ATOM 1369 CG PHE A 99 -19.824 43.907 -8.773 1.00 32.40 C ATOM 1370 CD1 PHE A 99 -21.135 43.907 -8.318 1.00 35.21 C ATOM 1371 CD2 PHE A 99 -19.592 43.847 -10.137 1.00 37.20 C ATOM 1372 CE1 PHE A 99 -22.197 43.818 -9.208 1.00 37.45 C ATOM 1373 CE2 PHE A 99 -20.647 43.737 -11.026 1.00 38.39 C ATOM 1374 CZ PHE A 99 -21.950 43.748 -10.561 1.00 36.86 C ATOM 1375 HA PHE A 99 -18.989 42.218 -6.630 1.00 0.00 H ATOM 1376 HB2 PHE A 99 -18.978 44.594 -6.956 1.00 0.00 H ATOM 1377 HB3 PHE A 99 -17.832 44.461 -8.311 1.00 0.00 H ATOM 1378 HD2 PHE A 99 -18.570 43.887 -10.514 1.00 0.00 H ATOM 1379 HE2 PHE A 99 -20.451 43.642 -12.094 1.00 0.00 H ATOM 1380 HZ PHE A 99 -22.781 43.701 -11.265 1.00 0.00 H ATOM 1381 HE1 PHE A 99 -23.222 43.804 -8.837 1.00 0.00 H ATOM 1382 HD1 PHE A 99 -21.334 43.978 -7.249 1.00 0.00 H ATOM 1383 H PHE A 99 -16.092 42.442 -6.916 1.00 0.00 H ATOM 1384 N SER A 100 -19.055 40.925 -8.816 1.00 34.25 N ATOM 1385 CA SER A 100 -18.944 40.044 -9.974 1.00 29.04 C ATOM 1386 C SER A 100 -20.338 39.734 -10.469 1.00 32.84 C ATOM 1387 O SER A 100 -21.287 39.817 -9.696 1.00 32.10 O ATOM 1388 CB SER A 100 -18.251 38.745 -9.573 1.00 28.65 C ATOM 1389 OG SER A 100 -18.033 37.922 -10.705 1.00 28.90 O ATOM 1390 HA SER A 100 -18.360 40.530 -10.756 1.00 0.00 H ATOM 1391 HB2 SER A 100 -18.877 38.211 -8.858 1.00 0.00 H ATOM 1392 HB3 SER A 100 -17.292 38.979 -9.111 1.00 0.00 H ATOM 1393 HG SER A 100 -17.461 38.402 -11.355 1.00 0.00 H ATOM 1394 H SER A 100 -19.950 40.987 -8.290 1.00 0.00 H ATOM 1395 N ASP A 101 -20.473 39.474 -11.768 1.00 34.76 N ATOM 1396 CA ASP A 101 -21.742 38.999 -12.315 1.00 42.41 C ATOM 1397 C ASP A 101 -21.647 37.509 -12.650 1.00 33.97 C ATOM 1398 O ASP A 101 -22.583 36.912 -13.175 1.00 38.78 O ATOM 1399 CB ASP A 101 -22.171 39.827 -13.534 1.00 42.46 C ATOM 1400 CG ASP A 101 -21.259 39.630 -14.732 1.00 47.16 C ATOM 1401 OD1 ASP A 101 -20.246 38.904 -14.616 1.00 40.42 O ATOM 1402 OD2 ASP A 101 -21.569 40.202 -15.796 1.00 46.72 O ATOM 1403 HA ASP A 101 -22.514 39.129 -11.557 1.00 0.00 H ATOM 1404 HB2 ASP A 101 -23.183 39.535 -13.815 1.00 0.00 H ATOM 1405 HB3 ASP A 101 -22.162 40.882 -13.259 1.00 0.00 H ATOM 1406 H ASP A 101 -19.662 39.611 -12.404 1.00 0.00 H ATOM 1407 N TYR A 102 -20.499 36.916 -12.338 1.00 34.85 N ATOM 1408 CA TYR A 102 -20.342 35.468 -12.404 1.00 39.11 C ATOM 1409 C TYR A 102 -20.329 34.979 -13.849 1.00 42.62 C ATOM 1410 O TYR A 102 -20.487 33.787 -14.112 1.00 37.62 O ATOM 1411 CB TYR A 102 -21.457 34.772 -11.623 1.00 35.62 C ATOM 1412 CG TYR A 102 -21.424 35.042 -10.136 1.00 40.88 C ATOM 1413 CD1 TYR A 102 -20.258 35.465 -9.513 1.00 37.16 C ATOM 1414 CD2 TYR A 102 -22.560 34.874 -9.354 1.00 44.37 C ATOM 1415 CE1 TYR A 102 -20.223 35.713 -8.154 1.00 34.30 C ATOM 1416 CE2 TYR A 102 -22.535 35.120 -7.995 1.00 41.24 C ATOM 1417 CZ TYR A 102 -21.364 35.539 -7.400 1.00 49.11 C ATOM 1418 OH TYR A 102 -21.334 35.785 -6.046 1.00 46.90 O ATOM 1419 HA TYR A 102 -19.383 35.216 -11.951 1.00 0.00 H ATOM 1420 HB3 TYR A 102 -21.366 33.697 -11.779 1.00 0.00 H ATOM 1421 HB2 TYR A 102 -22.415 35.115 -12.013 1.00 0.00 H ATOM 1422 HD2 TYR A 102 -23.487 34.542 -9.821 1.00 0.00 H ATOM 1423 HE2 TYR A 102 -23.436 34.984 -7.397 1.00 0.00 H ATOM 1424 HE1 TYR A 102 -19.299 36.044 -7.681 1.00 0.00 H ATOM 1425 HD1 TYR A 102 -19.354 35.604 -10.106 1.00 0.00 H ATOM 1426 HH TYR A 102 -20.424 36.075 -5.785 1.00 0.00 H ATOM 1427 H TYR A 102 -19.692 37.500 -12.039 1.00 0.00 H ATOM 1428 N ARG A 103 -20.141 35.907 -14.781 1.00 43.95 N ATOM 1429 CA ARG A 103 -20.349 35.624 -16.196 1.00 48.77 C ATOM 1430 C ARG A 103 -19.276 36.286 -17.055 1.00 47.66 C ATOM 1431 O ARG A 103 -18.496 35.607 -17.723 1.00 49.17 O ATOM 1432 CB ARG A 103 -21.737 36.091 -16.638 1.00 45.85 C ATOM 1433 CG ARG A 103 -22.807 35.013 -16.565 1.00 63.40 C ATOM 1434 CD ARG A 103 -24.066 35.434 -17.306 1.00 82.13 C ATOM 1435 NE ARG A 103 -24.860 36.388 -16.538 1.00 90.51 N ATOM 1436 CZ ARG A 103 -26.150 36.627 -16.749 1.00 89.66 C ATOM 1437 NH1 ARG A 103 -26.798 35.981 -17.709 1.00 77.63 N ATOM 1438 NH2 ARG A 103 -26.793 37.513 -16.001 1.00 90.32 N ATOM 1439 HA ARG A 103 -20.278 34.545 -16.333 1.00 0.00 H ATOM 1440 HB2 ARG A 103 -22.040 36.919 -15.997 1.00 0.00 H ATOM 1441 HB3 ARG A 103 -21.670 36.438 -17.669 1.00 0.00 H ATOM 1442 HG2 ARG A 103 -22.420 34.097 -17.013 1.00 0.00 H ATOM 1443 HG3 ARG A 103 -23.055 34.828 -15.520 1.00 0.00 H ATOM 1444 HD2 ARG A 103 -24.672 34.549 -17.502 1.00 0.00 H ATOM 1445 HD3 ARG A 103 -23.781 35.894 -18.252 1.00 0.00 H ATOM 1446 HE ARG A 103 -24.386 36.914 -15.777 1.00 0.00 H ATOM 1447 HH12 ARG A 103 -27.808 36.169 -17.873 1.00 0.00 H ATOM 1448 HH11 ARG A 103 -26.297 35.286 -18.298 1.00 0.00 H ATOM 1449 HH22 ARG A 103 -27.803 37.699 -16.167 1.00 0.00 H ATOM 1450 HH21 ARG A 103 -26.288 38.022 -15.248 1.00 0.00 H ATOM 1451 H ARG A 103 -19.838 36.859 -14.494 1.00 0.00 H ATOM 1452 N SER A 104 -19.242 37.614 -17.032 1.00 42.59 N ATOM 1453 CA SER A 104 -18.404 38.375 -17.951 1.00 41.91 C ATOM 1454 C SER A 104 -17.285 39.176 -17.299 1.00 37.88 C ATOM 1455 O SER A 104 -16.276 39.465 -17.942 1.00 38.09 O ATOM 1456 CB SER A 104 -19.264 39.291 -18.826 1.00 42.61 C ATOM 1457 OG SER A 104 -20.006 40.202 -18.038 1.00 45.48 O ATOM 1458 HA SER A 104 -17.902 37.622 -18.559 1.00 0.00 H ATOM 1459 HB2 SER A 104 -19.954 38.681 -19.409 1.00 0.00 H ATOM 1460 HB3 SER A 104 -18.616 39.850 -19.501 1.00 0.00 H ATOM 1461 HG SER A 104 -20.600 39.699 -17.426 1.00 0.00 H ATOM 1462 H SER A 104 -19.828 38.124 -16.341 1.00 0.00 H ATOM 1463 N CYS A 105 -17.498 39.632 -16.071 1.00 40.10 N ATOM 1464 CA CYS A 105 -16.542 40.558 -15.468 1.00 36.98 C ATOM 1465 C CYS A 105 -16.507 40.487 -13.945 1.00 33.60 C ATOM 1466 O CYS A 105 -17.481 40.087 -13.307 1.00 36.62 O ATOM 1467 CB CYS A 105 -16.824 41.992 -15.937 1.00 38.05 C ATOM 1468 SG CYS A 105 -18.425 42.625 -15.391 1.00 55.53 S ATOM 1469 HA CYS A 105 -15.553 40.250 -15.808 1.00 0.00 H ATOM 1470 HB2 CYS A 105 -16.798 42.011 -17.027 1.00 0.00 H ATOM 1471 HB3 CYS A 105 -16.043 42.644 -15.545 1.00 0.00 H ATOM 1472 H CYS A 105 -18.341 39.332 -15.541 1.00 0.00 H ATOM 1473 N ASP A 106 -15.397 40.889 -13.352 1.00 29.58 N ATOM 1474 CA ASP A 106 -15.224 40.950 -11.923 1.00 26.71 C ATOM 1475 C ASP A 106 -14.549 42.249 -11.562 1.00 25.11 C ATOM 1476 O ASP A 106 -13.740 42.731 -12.313 1.00 31.19 O ATOM 1477 CB ASP A 106 -14.286 39.875 -11.428 1.00 30.37 C ATOM 1478 CG ASP A 106 -14.594 38.530 -11.957 1.00 36.29 C ATOM 1479 OD1 ASP A 106 -15.636 37.984 -11.650 1.00 35.89 O ATOM 1480 OD2 ASP A 106 -13.740 37.995 -12.625 1.00 41.33 O ATOM 1481 HA ASP A 106 -16.214 40.838 -11.480 1.00 0.00 H ATOM 1482 HB2 ASP A 106 -13.271 40.139 -11.726 1.00 0.00 H ATOM 1483 HB3 ASP A 106 -14.346 39.840 -10.340 1.00 0.00 H ATOM 1484 H ASP A 106 -14.600 41.179 -13.953 1.00 0.00 H ATOM 1485 N VAL A 107 -14.808 42.769 -10.380 1.00 27.07 N ATOM 1486 CA VAL A 107 -13.951 43.805 -9.813 1.00 24.89 C ATOM 1487 C VAL A 107 -13.326 43.257 -8.527 1.00 28.57 C ATOM 1488 O VAL A 107 -14.035 42.779 -7.655 1.00 28.50 O ATOM 1489 CB VAL A 107 -14.765 45.066 -9.496 1.00 24.81 C ATOM 1490 CG1 VAL A 107 -13.862 46.120 -8.792 1.00 23.99 C ATOM 1491 CG2 VAL A 107 -15.387 45.602 -10.797 1.00 25.77 C ATOM 1492 HA VAL A 107 -13.176 44.073 -10.531 1.00 0.00 H ATOM 1493 HB VAL A 107 -15.577 44.832 -8.807 1.00 0.00 H ATOM 1494 HG11 VAL A 107 -13.473 45.701 -7.864 1.00 0.00 H ATOM 1495 HG12 VAL A 107 -13.033 46.383 -9.449 1.00 0.00 H ATOM 1496 HG13 VAL A 107 -14.450 47.011 -8.572 1.00 0.00 H ATOM 1497 HG21 VAL A 107 -14.594 45.844 -11.504 1.00 0.00 H ATOM 1498 HG22 VAL A 107 -16.039 44.842 -11.227 1.00 0.00 H ATOM 1499 HG23 VAL A 107 -15.967 46.499 -10.578 1.00 0.00 H ATOM 1500 H VAL A 107 -15.635 42.437 -9.843 1.00 0.00 H ATOM 1501 N MET A 108 -12.004 43.361 -8.414 1.00 25.26 N ATOM 1502 CA MET A 108 -11.273 42.756 -7.320 1.00 28.70 C ATOM 1503 C MET A 108 -10.495 43.830 -6.565 1.00 26.76 C ATOM 1504 O MET A 108 -10.095 44.854 -7.141 1.00 28.04 O ATOM 1505 CB MET A 108 -10.217 41.777 -7.875 1.00 29.02 C ATOM 1506 CG MET A 108 -10.734 40.702 -8.819 1.00 33.17 C ATOM 1507 SD MET A 108 -12.014 39.674 -8.107 1.00 33.06 S ATOM 1508 CE MET A 108 -11.904 38.260 -9.215 1.00 41.29 C ATOM 1509 HA MET A 108 -11.990 42.249 -6.675 1.00 0.00 H ATOM 1510 HB2 MET A 108 -9.470 42.361 -8.412 1.00 0.00 H ATOM 1511 HB3 MET A 108 -9.746 41.279 -7.028 1.00 0.00 H ATOM 1512 HG2 MET A 108 -9.898 40.063 -9.104 1.00 0.00 H ATOM 1513 HG3 MET A 108 -11.137 41.189 -9.707 1.00 0.00 H ATOM 1514 HE1 MET A 108 -12.105 38.584 -10.236 1.00 0.00 H ATOM 1515 HE2 MET A 108 -10.903 37.833 -9.159 1.00 0.00 H ATOM 1516 HE3 MET A 108 -12.638 37.510 -8.919 1.00 0.00 H ATOM 1517 H MET A 108 -11.478 43.895 -9.135 1.00 0.00 H ATOM 1518 N ARG A 109 -10.113 43.482 -5.340 1.00 28.32 N ATOM 1519 CA ARG A 109 -8.961 44.122 -4.706 1.00 29.08 C ATOM 1520 C ARG A 109 -7.829 43.082 -4.790 1.00 29.82 C ATOM 1521 O ARG A 109 -7.975 41.986 -4.278 1.00 36.69 O ATOM 1522 CB ARG A 109 -9.248 44.457 -3.241 1.00 33.70 C ATOM 1523 CG ARG A 109 -8.112 45.248 -2.572 1.00 33.93 C ATOM 1524 CD ARG A 109 -8.427 45.574 -1.102 1.00 37.96 C ATOM 1525 NE ARG A 109 -9.602 46.434 -1.002 1.00 48.48 N ATOM 1526 CZ ARG A 109 -10.761 46.085 -0.449 1.00 60.01 C ATOM 1527 NH1 ARG A 109 -10.885 44.932 0.204 1.00 61.20 N ATOM 1528 NH2 ARG A 109 -11.791 46.918 -0.520 1.00 53.53 N ATOM 1529 HA ARG A 109 -8.709 45.061 -5.199 1.00 0.00 H ATOM 1530 HB2 ARG A 109 -10.161 45.051 -3.193 1.00 0.00 H ATOM 1531 HB3 ARG A 109 -9.393 43.526 -2.693 1.00 0.00 H ATOM 1532 HG2 ARG A 109 -7.198 44.656 -2.614 1.00 0.00 H ATOM 1533 HG3 ARG A 109 -7.964 46.181 -3.116 1.00 0.00 H ATOM 1534 HD2 ARG A 109 -7.572 46.083 -0.658 1.00 0.00 H ATOM 1535 HD3 ARG A 109 -8.616 44.646 -0.562 1.00 0.00 H ATOM 1536 HE ARG A 109 -9.528 47.395 -1.394 1.00 0.00 H ATOM 1537 HH12 ARG A 109 -11.797 44.672 0.631 1.00 0.00 H ATOM 1538 HH11 ARG A 109 -10.070 44.291 0.287 1.00 0.00 H ATOM 1539 HH22 ARG A 109 -12.702 46.656 -0.092 1.00 0.00 H ATOM 1540 HH21 ARG A 109 -11.688 47.833 -1.004 1.00 0.00 H ATOM 1541 H ARG A 109 -10.639 42.746 -4.827 1.00 0.00 H ATOM 1542 N GLY A 110 -6.757 43.397 -5.510 1.00 37.42 N ATOM 1543 CA GLY A 110 -5.619 42.473 -5.675 1.00 35.47 C ATOM 1544 C GLY A 110 -4.776 42.377 -4.414 1.00 35.90 C ATOM 1545 O GLY A 110 -5.012 43.100 -3.447 1.00 30.85 O ATOM 1546 HA3 GLY A 110 -4.991 42.829 -6.492 1.00 0.00 H ATOM 1547 HA2 GLY A 110 -6.002 41.482 -5.919 1.00 0.00 H ATOM 1548 H GLY A 110 -6.719 44.327 -5.973 1.00 0.00 H ATOM 1549 N PRO A 111 -3.819 41.438 -4.382 1.00 35.96 N ATOM 1550 CA PRO A 111 -3.106 41.193 -3.117 1.00 41.67 C ATOM 1551 C PRO A 111 -2.316 42.396 -2.582 1.00 40.62 C ATOM 1552 O PRO A 111 -2.303 42.619 -1.373 1.00 45.38 O ATOM 1553 CB PRO A 111 -2.178 40.008 -3.451 1.00 36.96 C ATOM 1554 CG PRO A 111 -2.757 39.389 -4.641 1.00 39.90 C ATOM 1555 CD PRO A 111 -3.454 40.459 -5.423 1.00 41.96 C ATOM 1556 HA PRO A 111 -3.809 40.992 -2.309 1.00 0.00 H ATOM 1557 HD3 PRO A 111 -2.788 40.902 -6.163 1.00 0.00 H ATOM 1558 HD2 PRO A 111 -4.340 40.067 -5.922 1.00 0.00 H ATOM 1559 HG3 PRO A 111 -3.471 38.619 -4.348 1.00 0.00 H ATOM 1560 HG2 PRO A 111 -1.969 38.941 -5.246 1.00 0.00 H ATOM 1561 HB2 PRO A 111 -1.167 40.360 -3.657 1.00 0.00 H ATOM 1562 HB3 PRO A 111 -2.153 39.298 -2.625 1.00 0.00 H ATOM 1563 N ASP A 112 -1.848 43.263 -3.482 1.00 38.97 N ATOM 1564 CA ASP A 112 -1.106 44.469 -3.100 1.00 33.72 C ATOM 1565 C ASP A 112 -1.989 45.622 -2.625 1.00 38.26 C ATOM 1566 O ASP A 112 -1.477 46.667 -2.216 1.00 36.03 O ATOM 1567 CB ASP A 112 -0.245 44.957 -4.270 1.00 33.73 C ATOM 1568 CG ASP A 112 0.915 44.012 -4.585 1.00 44.20 C ATOM 1569 OD1 ASP A 112 1.076 42.978 -3.888 1.00 48.74 O ATOM 1570 OD2 ASP A 112 1.654 44.291 -5.555 1.00 52.13 O ATOM 1571 HA ASP A 112 -0.487 44.171 -2.254 1.00 0.00 H ATOM 1572 HB2 ASP A 112 -0.875 45.043 -5.155 1.00 0.00 H ATOM 1573 HB3 ASP A 112 0.162 45.937 -4.019 1.00 0.00 H ATOM 1574 H ASP A 112 -2.016 43.077 -4.491 1.00 0.00 H ATOM 1575 N GLY A 113 -3.307 45.442 -2.701 1.00 35.76 N ATOM 1576 CA GLY A 113 -4.272 46.462 -2.276 1.00 35.02 C ATOM 1577 C GLY A 113 -4.817 47.297 -3.421 1.00 33.35 C ATOM 1578 O GLY A 113 -5.643 48.181 -3.229 1.00 37.74 O ATOM 1579 HA3 GLY A 113 -3.780 47.128 -1.567 1.00 0.00 H ATOM 1580 HA2 GLY A 113 -5.107 45.963 -1.785 1.00 0.00 H ATOM 1581 H GLY A 113 -3.666 44.541 -3.077 1.00 0.00 H ATOM 1582 N ASN A 114 -4.326 47.061 -4.603 1.00 34.93 N ATOM 1583 CA ASN A 114 -4.789 47.718 -5.790 1.00 33.84 C ATOM 1584 C ASN A 114 -6.172 47.231 -6.244 1.00 34.26 C ATOM 1585 O ASN A 114 -6.599 46.209 -5.834 1.00 32.89 O ATOM 1586 CB ASN A 114 -3.774 47.477 -6.876 1.00 32.73 C ATOM 1587 CG ASN A 114 -3.628 46.033 -7.200 1.00 40.30 C ATOM 1588 OD1 ASN A 114 -3.130 45.271 -6.428 1.00 42.12 O ATOM 1589 ND2 ASN A 114 -4.130 45.657 -8.312 1.00 34.60 N ATOM 1590 HA ASN A 114 -4.898 48.781 -5.575 1.00 0.00 H ATOM 1591 HB2 ASN A 114 -4.088 48.008 -7.774 1.00 0.00 H ATOM 1592 HB3 ASN A 114 -2.809 47.862 -6.546 1.00 0.00 H ATOM 1593 HD22 ASN A 114 -4.554 46.357 -8.954 1.00 0.00 H ATOM 1594 HD21 ASN A 114 -4.115 44.651 -8.576 1.00 0.00 H ATOM 1595 H ASN A 114 -3.561 46.362 -4.691 1.00 0.00 H ATOM 1596 N TYR A 115 -6.837 47.998 -7.088 1.00 31.28 N ATOM 1597 CA TYR A 115 -8.075 47.575 -7.672 1.00 30.46 C ATOM 1598 C TYR A 115 -7.937 47.077 -9.091 1.00 28.63 C ATOM 1599 O TYR A 115 -7.136 47.552 -9.809 1.00 25.73 O ATOM 1600 CB TYR A 115 -9.142 48.665 -7.564 1.00 30.02 C ATOM 1601 CG TYR A 115 -9.369 49.076 -6.150 1.00 34.23 C ATOM 1602 CD1 TYR A 115 -10.013 48.252 -5.297 1.00 32.34 C ATOM 1603 CD2 TYR A 115 -8.862 50.250 -5.659 1.00 38.61 C ATOM 1604 CE1 TYR A 115 -10.190 48.585 -4.021 1.00 49.34 C ATOM 1605 CE2 TYR A 115 -9.036 50.598 -4.363 1.00 40.86 C ATOM 1606 CZ TYR A 115 -9.701 49.760 -3.545 1.00 48.10 C ATOM 1607 OH TYR A 115 -9.906 50.016 -2.255 1.00 46.80 O ATOM 1608 HA TYR A 115 -8.402 46.715 -7.087 1.00 0.00 H ATOM 1609 HB3 TYR A 115 -10.077 48.286 -7.977 1.00 0.00 H ATOM 1610 HB2 TYR A 115 -8.819 49.534 -8.137 1.00 0.00 H ATOM 1611 HD2 TYR A 115 -8.309 50.915 -6.323 1.00 0.00 H ATOM 1612 HE2 TYR A 115 -8.644 51.543 -3.987 1.00 0.00 H ATOM 1613 HE1 TYR A 115 -10.730 47.912 -3.355 1.00 0.00 H ATOM 1614 HD1 TYR A 115 -10.395 47.298 -5.660 1.00 0.00 H ATOM 1615 HH TYR A 115 -10.423 50.856 -2.164 1.00 0.00 H ATOM 1616 H TYR A 115 -6.453 48.932 -7.335 1.00 0.00 H ATOM 1617 N GLU A 116 -8.796 46.154 -9.477 1.00 30.83 N ATOM 1618 CA GLU A 116 -8.643 45.439 -10.744 1.00 31.02 C ATOM 1619 C GLU A 116 -9.985 45.196 -11.399 1.00 28.92 C ATOM 1620 O GLU A 116 -10.937 44.769 -10.742 1.00 27.72 O ATOM 1621 CB GLU A 116 -7.982 44.079 -10.499 1.00 30.50 C ATOM 1622 CG GLU A 116 -6.561 44.192 -9.934 1.00 34.47 C ATOM 1623 CD GLU A 116 -5.935 42.837 -9.642 1.00 43.31 C ATOM 1624 OE1 GLU A 116 -6.674 41.822 -9.640 1.00 40.35 O ATOM 1625 OE2 GLU A 116 -4.726 42.803 -9.315 1.00 38.85 O ATOM 1626 HA GLU A 116 -8.026 46.056 -11.398 1.00 0.00 H ATOM 1627 HB2 GLU A 116 -8.593 43.519 -9.791 1.00 0.00 H ATOM 1628 HB3 GLU A 116 -7.937 43.540 -11.445 1.00 0.00 H ATOM 1629 HG2 GLU A 116 -5.938 44.715 -10.659 1.00 0.00 H ATOM 1630 HG3 GLU A 116 -6.598 44.766 -9.008 1.00 0.00 H ATOM 1631 H GLU A 116 -9.605 45.928 -8.864 1.00 0.00 H ATOM 1632 N LEU A 117 -10.015 45.338 -12.714 1.00 28.15 N ATOM 1633 CA LEU A 117 -11.175 44.922 -13.482 1.00 29.41 C ATOM 1634 C LEU A 117 -10.741 43.770 -14.377 1.00 30.36 C ATOM 1635 O LEU A 117 -9.868 43.941 -15.221 1.00 32.15 O ATOM 1636 CB LEU A 117 -11.675 46.092 -14.338 1.00 29.55 C ATOM 1637 CG LEU A 117 -12.774 45.789 -15.362 1.00 35.29 C ATOM 1638 CD1 LEU A 117 -14.052 45.343 -14.680 1.00 29.49 C ATOM 1639 CD2 LEU A 117 -13.027 47.030 -16.218 1.00 30.74 C ATOM 1640 HA LEU A 117 -11.985 44.609 -12.823 1.00 0.00 H ATOM 1641 HB2 LEU A 117 -12.059 46.854 -13.660 1.00 0.00 H ATOM 1642 HB3 LEU A 117 -10.819 46.490 -14.883 1.00 0.00 H ATOM 1643 HG LEU A 117 -12.441 44.971 -16.000 1.00 0.00 H ATOM 1644 HD21 LEU A 117 -13.343 47.853 -15.577 1.00 0.00 H ATOM 1645 HD22 LEU A 117 -12.109 47.304 -16.738 1.00 0.00 H ATOM 1646 HD23 LEU A 117 -13.809 46.814 -16.946 1.00 0.00 H ATOM 1647 HD11 LEU A 117 -13.857 44.440 -14.101 1.00 0.00 H ATOM 1648 HD12 LEU A 117 -14.403 46.133 -14.016 1.00 0.00 H ATOM 1649 HD13 LEU A 117 -14.811 45.136 -15.434 1.00 0.00 H ATOM 1650 H LEU A 117 -9.197 45.753 -13.204 1.00 0.00 H ATOM 1651 N TRP A 118 -11.380 42.632 -14.221 1.00 29.04 N ATOM 1652 CA TRP A 118 -11.123 41.481 -15.044 1.00 28.45 C ATOM 1653 C TRP A 118 -12.302 41.241 -15.949 1.00 30.77 C ATOM 1654 O TRP A 118 -13.402 41.364 -15.526 1.00 31.89 O ATOM 1655 CB TRP A 118 -10.832 40.272 -14.192 1.00 28.21 C ATOM 1656 CG TRP A 118 -9.625 40.300 -13.388 1.00 26.49 C ATOM 1657 CD1 TRP A 118 -9.459 40.928 -12.238 1.00 27.25 C ATOM 1658 CD2 TRP A 118 -8.397 39.663 -13.676 1.00 30.76 C ATOM 1659 NE1 TRP A 118 -8.223 40.737 -11.761 1.00 30.20 N ATOM 1660 CE2 TRP A 118 -7.531 39.963 -12.641 1.00 33.64 C ATOM 1661 CE3 TRP A 118 -7.937 38.875 -14.715 1.00 35.19 C ATOM 1662 CZ2 TRP A 118 -6.250 39.473 -12.592 1.00 30.14 C ATOM 1663 CZ3 TRP A 118 -6.665 38.412 -14.663 1.00 32.61 C ATOM 1664 CH2 TRP A 118 -5.840 38.697 -13.621 1.00 33.61 C ATOM 1665 HA TRP A 118 -10.242 41.666 -15.659 1.00 0.00 H ATOM 1666 HB2 TRP A 118 -11.675 40.139 -13.514 1.00 0.00 H ATOM 1667 HB3 TRP A 118 -10.763 39.411 -14.857 1.00 0.00 H ATOM 1668 HE1 TRP A 118 -7.853 41.117 -10.866 1.00 0.00 H ATOM 1669 HD1 TRP A 118 -10.227 41.523 -11.743 1.00 0.00 H ATOM 1670 HZ2 TRP A 118 -5.589 39.700 -11.756 1.00 0.00 H ATOM 1671 HH2 TRP A 118 -4.828 38.292 -13.615 1.00 0.00 H ATOM 1672 HZ3 TRP A 118 -6.293 37.794 -15.480 1.00 0.00 H ATOM 1673 HE3 TRP A 118 -8.584 38.632 -15.558 1.00 0.00 H ATOM 1674 H TRP A 118 -12.099 42.561 -13.473 1.00 0.00 H ATOM 1675 N VAL A 119 -12.062 40.951 -17.218 1.00 34.31 N ATOM 1676 CA VAL A 119 -13.161 40.754 -18.169 1.00 29.51 C ATOM 1677 C VAL A 119 -13.000 39.453 -18.946 1.00 32.79 C ATOM 1678 O VAL A 119 -11.901 39.113 -19.385 1.00 31.16 O ATOM 1679 CB VAL A 119 -13.325 41.950 -19.143 1.00 36.54 C ATOM 1680 CG1 VAL A 119 -14.609 41.798 -19.975 1.00 30.61 C ATOM 1681 CG2 VAL A 119 -13.349 43.260 -18.379 1.00 30.86 C ATOM 1682 HA VAL A 119 -14.072 40.691 -17.574 1.00 0.00 H ATOM 1683 HB VAL A 119 -12.471 41.957 -19.820 1.00 0.00 H ATOM 1684 HG11 VAL A 119 -14.559 40.875 -20.553 1.00 0.00 H ATOM 1685 HG12 VAL A 119 -15.471 41.764 -19.308 1.00 0.00 H ATOM 1686 HG13 VAL A 119 -14.705 42.647 -20.651 1.00 0.00 H ATOM 1687 HG21 VAL A 119 -14.185 43.256 -17.679 1.00 0.00 H ATOM 1688 HG22 VAL A 119 -12.415 43.376 -17.830 1.00 0.00 H ATOM 1689 HG23 VAL A 119 -13.465 44.086 -19.081 1.00 0.00 H ATOM 1690 H VAL A 119 -11.079 40.861 -17.546 1.00 0.00 H ATOM 1691 N HIS A 120 -14.084 38.678 -19.000 1.00 35.11 N ATOM 1692 CA HIS A 120 -14.109 37.399 -19.698 1.00 36.47 C ATOM 1693 C HIS A 120 -13.804 37.567 -21.190 1.00 35.06 C ATOM 1694 O HIS A 120 -14.217 38.547 -21.804 1.00 31.50 O ATOM 1695 CB HIS A 120 -15.484 36.746 -19.516 1.00 31.88 C ATOM 1696 CG HIS A 120 -15.535 35.316 -19.942 1.00 35.39 C ATOM 1697 ND1 HIS A 120 -16.013 34.928 -21.174 1.00 36.23 N ATOM 1698 CD2 HIS A 120 -15.091 34.190 -19.337 1.00 39.27 C ATOM 1699 CE1 HIS A 120 -15.845 33.626 -21.317 1.00 35.35 C ATOM 1700 NE2 HIS A 120 -15.289 33.154 -20.217 1.00 40.62 N ATOM 1701 HA HIS A 120 -13.335 36.761 -19.271 1.00 0.00 H ATOM 1702 HB2 HIS A 120 -15.753 36.800 -18.461 1.00 0.00 H ATOM 1703 HB3 HIS A 120 -16.211 37.306 -20.104 1.00 0.00 H ATOM 1704 HD2 HIS A 120 -14.658 34.119 -18.339 1.00 0.00 H ATOM 1705 HE1 HIS A 120 -16.119 33.040 -22.195 1.00 0.00 H ATOM 1706 H HIS A 120 -14.950 39.001 -18.523 1.00 0.00 H ATOM 1707 N SER A 121 -13.083 36.605 -21.763 1.00 38.43 N ATOM 1708 CA SER A 121 -12.743 36.636 -23.189 1.00 41.14 C ATOM 1709 C SER A 121 -13.955 36.863 -24.111 1.00 42.98 C ATOM 1710 O SER A 121 -13.847 37.548 -25.125 1.00 37.26 O ATOM 1711 CB SER A 121 -11.990 35.370 -23.592 1.00 41.34 C ATOM 1712 OG SER A 121 -12.620 34.221 -23.045 1.00 42.18 O ATOM 1713 HA SER A 121 -12.095 37.502 -23.324 1.00 0.00 H ATOM 1714 HB2 SER A 121 -10.966 35.428 -23.222 1.00 0.00 H ATOM 1715 HB3 SER A 121 -11.978 35.290 -24.679 1.00 0.00 H ATOM 1716 HG SER A 121 -12.629 34.290 -22.057 1.00 0.00 H ATOM 1717 H SER A 121 -12.751 35.809 -21.182 1.00 0.00 H ATOM 1718 N SER A 122 -15.125 36.363 -23.726 1.00 41.14 N ATOM 1719 CA SER A 122 -16.326 36.619 -24.512 1.00 42.69 C ATOM 1720 C SER A 122 -16.764 38.087 -24.547 1.00 41.32 C ATOM 1721 O SER A 122 -17.461 38.506 -25.465 1.00 41.75 O ATOM 1722 CB SER A 122 -17.481 35.726 -24.052 1.00 42.68 C ATOM 1723 OG SER A 122 -17.959 36.120 -22.782 1.00 54.20 O ATOM 1724 HA SER A 122 -16.054 36.369 -25.538 1.00 0.00 H ATOM 1725 HB2 SER A 122 -17.133 34.695 -23.997 1.00 0.00 H ATOM 1726 HB3 SER A 122 -18.294 35.795 -24.775 1.00 0.00 H ATOM 1727 HG SER A 122 -17.226 36.054 -22.120 1.00 0.00 H ATOM 1728 H SER A 122 -15.184 35.788 -22.862 1.00 0.00 H ATOM 1729 N ALA A 123 -16.365 38.879 -23.555 1.00 39.49 N ATOM 1730 CA ALA A 123 -16.876 40.241 -23.443 1.00 36.76 C ATOM 1731 C ALA A 123 -15.801 41.313 -23.587 1.00 39.65 C ATOM 1732 O ALA A 123 -16.099 42.497 -23.548 1.00 40.46 O ATOM 1733 CB ALA A 123 -17.643 40.428 -22.125 1.00 40.14 C ATOM 1734 HA ALA A 123 -17.557 40.374 -24.284 1.00 0.00 H ATOM 1735 HB1 ALA A 123 -18.482 39.733 -22.093 1.00 0.00 H ATOM 1736 HB2 ALA A 123 -16.975 40.232 -21.286 1.00 0.00 H ATOM 1737 HB3 ALA A 123 -18.014 41.451 -22.064 1.00 0.00 H ATOM 1738 H ALA A 123 -15.684 38.524 -22.854 1.00 0.00 H ATOM 1739 N ILE A 124 -14.564 40.896 -23.814 1.00 35.48 N ATOM 1740 CA ILE A 124 -13.438 41.818 -23.752 1.00 37.77 C ATOM 1741 C ILE A 124 -13.445 42.914 -24.832 1.00 38.90 C ATOM 1742 O ILE A 124 -13.006 44.036 -24.581 1.00 39.90 O ATOM 1743 CB ILE A 124 -12.097 41.057 -23.720 1.00 36.78 C ATOM 1744 CG1 ILE A 124 -10.947 41.976 -23.299 1.00 40.41 C ATOM 1745 CG2 ILE A 124 -11.842 40.371 -25.069 1.00 35.67 C ATOM 1746 CD1 ILE A 124 -10.922 42.329 -21.822 1.00 28.00 C ATOM 1747 HA ILE A 124 -13.558 42.356 -22.812 1.00 0.00 H ATOM 1748 HB ILE A 124 -12.155 40.274 -22.964 1.00 0.00 H ATOM 1749 HG12 ILE A 124 -10.008 41.480 -23.545 1.00 0.00 H ATOM 1750 HG13 ILE A 124 -11.027 42.902 -23.868 1.00 0.00 H ATOM 1751 HD11 ILE A 124 -11.847 42.840 -21.556 1.00 0.00 H ATOM 1752 HD12 ILE A 124 -10.828 41.417 -21.233 1.00 0.00 H ATOM 1753 HD13 ILE A 124 -10.073 42.983 -21.620 1.00 0.00 H ATOM 1754 HG21 ILE A 124 -12.647 39.666 -25.275 1.00 0.00 H ATOM 1755 HG22 ILE A 124 -11.806 41.123 -25.857 1.00 0.00 H ATOM 1756 HG23 ILE A 124 -10.892 39.838 -25.030 1.00 0.00 H ATOM 1757 H ILE A 124 -14.394 39.895 -24.040 1.00 0.00 H ATOM 1758 N ASN A 125 -14.004 42.620 -26.004 1.00 42.44 N ATOM 1759 CA ASN A 125 -14.045 43.605 -27.100 1.00 45.42 C ATOM 1760 C ASN A 125 -15.271 44.523 -27.086 1.00 47.61 C ATOM 1761 O ASN A 125 -15.472 45.312 -28.013 1.00 50.53 O ATOM 1762 CB ASN A 125 -13.922 42.918 -28.473 1.00 43.78 C ATOM 1763 CG ASN A 125 -12.592 42.204 -28.654 1.00 41.55 C ATOM 1764 OD1 ASN A 125 -12.503 40.991 -28.474 1.00 41.19 O ATOM 1765 ND2 ASN A 125 -11.535 42.967 -28.913 1.00 40.80 N ATOM 1766 HA ASN A 125 -13.181 44.247 -26.927 1.00 0.00 H ATOM 1767 HB2 ASN A 125 -14.726 42.189 -28.572 1.00 0.00 H ATOM 1768 HB3 ASN A 125 -14.021 43.674 -29.252 1.00 0.00 H ATOM 1769 HD22 ASN A 125 -11.655 43.990 -29.059 1.00 0.00 H ATOM 1770 HD21 ASN A 125 -10.588 42.541 -28.970 1.00 0.00 H ATOM 1771 H ASN A 125 -14.420 41.678 -26.149 1.00 0.00 H ATOM 1772 N LEU A 126 -16.079 44.444 -26.032 1.00 47.16 N ATOM 1773 CA LEU A 126 -17.251 45.312 -25.934 1.00 50.60 C ATOM 1774 C LEU A 126 -16.833 46.755 -25.691 1.00 51.22 C ATOM 1775 O LEU A 126 -15.704 47.025 -25.275 1.00 53.27 O ATOM 1776 CB LEU A 126 -18.227 44.837 -24.848 1.00 47.49 C ATOM 1777 CG LEU A 126 -18.865 43.448 -24.978 1.00 50.64 C ATOM 1778 CD1 LEU A 126 -19.974 43.302 -23.959 1.00 48.09 C ATOM 1779 CD2 LEU A 126 -19.399 43.183 -26.377 1.00 56.10 C ATOM 1780 HA LEU A 126 -17.776 45.258 -26.887 1.00 0.00 H ATOM 1781 HB2 LEU A 126 -17.685 44.853 -23.902 1.00 0.00 H ATOM 1782 HB3 LEU A 126 -19.041 45.561 -24.811 1.00 0.00 H ATOM 1783 HG LEU A 126 -18.087 42.709 -24.790 1.00 0.00 H ATOM 1784 HD21 LEU A 126 -20.158 43.926 -26.622 1.00 0.00 H ATOM 1785 HD22 LEU A 126 -18.581 43.247 -27.095 1.00 0.00 H ATOM 1786 HD23 LEU A 126 -19.840 42.187 -26.414 1.00 0.00 H ATOM 1787 HD11 LEU A 126 -19.562 43.420 -22.957 1.00 0.00 H ATOM 1788 HD12 LEU A 126 -20.730 44.067 -24.135 1.00 0.00 H ATOM 1789 HD13 LEU A 126 -20.425 42.314 -24.054 1.00 0.00 H ATOM 1790 H LEU A 126 -15.876 43.761 -25.274 1.00 0.00 H ATOM 1791 N GLN A 127 -17.728 47.686 -25.999 1.00 56.33 N ATOM 1792 CA GLN A 127 -17.434 49.102 -25.816 1.00 60.06 C ATOM 1793 C GLN A 127 -17.570 49.550 -24.363 1.00 61.65 C ATOM 1794 O GLN A 127 -16.987 50.557 -23.959 1.00 61.34 O ATOM 1795 CB GLN A 127 -18.299 49.966 -26.736 1.00 57.80 C ATOM 1796 CG GLN A 127 -18.004 49.753 -28.211 1.00 68.63 C ATOM 1797 CD GLN A 127 -16.512 49.745 -28.500 1.00 77.17 C ATOM 1798 OE1 GLN A 127 -15.825 50.752 -28.324 1.00 74.82 O ATOM 1799 NE2 GLN A 127 -16.001 48.599 -28.934 1.00 73.17 N ATOM 1800 HA GLN A 127 -16.388 49.240 -26.091 1.00 0.00 H ATOM 1801 HB2 GLN A 127 -19.346 49.725 -26.554 1.00 0.00 H ATOM 1802 HB3 GLN A 127 -18.121 51.014 -26.495 1.00 0.00 H ATOM 1803 HG2 GLN A 127 -18.427 48.797 -28.520 1.00 0.00 H ATOM 1804 HG3 GLN A 127 -18.469 50.557 -28.782 1.00 0.00 H ATOM 1805 HE22 GLN A 127 -16.618 47.773 -29.069 1.00 0.00 H ATOM 1806 HE21 GLN A 127 -14.984 48.528 -29.139 1.00 0.00 H ATOM 1807 H GLN A 127 -18.654 47.400 -26.377 1.00 0.00 H ATOM 1808 N SER A 128 -18.330 48.797 -23.576 1.00 59.33 N ATOM 1809 CA SER A 128 -18.510 49.128 -22.165 1.00 60.44 C ATOM 1810 C SER A 128 -18.761 47.859 -21.370 1.00 53.71 C ATOM 1811 O SER A 128 -19.452 46.958 -21.836 1.00 58.33 O ATOM 1812 CB SER A 128 -19.673 50.106 -21.977 1.00 62.08 C ATOM 1813 OG SER A 128 -20.916 49.458 -22.188 1.00 66.06 O ATOM 1814 HA SER A 128 -17.601 49.608 -21.802 1.00 0.00 H ATOM 1815 HB2 SER A 128 -19.571 50.924 -22.690 1.00 0.00 H ATOM 1816 HB3 SER A 128 -19.645 50.504 -20.963 1.00 0.00 H ATOM 1817 HG SER A 128 -21.014 48.716 -21.540 1.00 0.00 H ATOM 1818 H SER A 128 -18.804 47.959 -23.970 1.00 0.00 H ATOM 1819 N TYR A 129 -18.230 47.806 -20.155 1.00 49.10 N ATOM 1820 CA TYR A 129 -18.317 46.593 -19.361 1.00 44.77 C ATOM 1821 C TYR A 129 -19.434 46.672 -18.321 1.00 47.86 C ATOM 1822 O TYR A 129 -19.452 45.923 -17.345 1.00 50.03 O ATOM 1823 CB TYR A 129 -16.955 46.272 -18.738 1.00 45.90 C ATOM 1824 CG TYR A 129 -15.830 46.181 -19.768 1.00 37.71 C ATOM 1825 CD1 TYR A 129 -15.829 45.181 -20.743 1.00 43.07 C ATOM 1826 CD2 TYR A 129 -14.763 47.072 -19.743 1.00 35.82 C ATOM 1827 CE1 TYR A 129 -14.806 45.087 -21.677 1.00 42.18 C ATOM 1828 CE2 TYR A 129 -13.743 46.996 -20.670 1.00 37.13 C ATOM 1829 CZ TYR A 129 -13.775 46.012 -21.646 1.00 37.58 C ATOM 1830 OH TYR A 129 -12.740 45.921 -22.558 1.00 36.68 O ATOM 1831 HA TYR A 129 -18.583 45.767 -20.020 1.00 0.00 H ATOM 1832 HB3 TYR A 129 -17.028 45.317 -18.218 1.00 0.00 H ATOM 1833 HB2 TYR A 129 -16.707 47.056 -18.022 1.00 0.00 H ATOM 1834 HD2 TYR A 129 -14.731 47.846 -18.976 1.00 0.00 H ATOM 1835 HE2 TYR A 129 -12.917 47.706 -20.635 1.00 0.00 H ATOM 1836 HE1 TYR A 129 -14.814 44.295 -22.426 1.00 0.00 H ATOM 1837 HD1 TYR A 129 -16.647 44.461 -20.771 1.00 0.00 H ATOM 1838 HH TYR A 129 -12.916 45.172 -23.181 1.00 0.00 H ATOM 1839 H TYR A 129 -17.747 48.641 -19.767 1.00 0.00 H ATOM 1840 N GLY A 130 -20.369 47.592 -18.545 1.00 46.80 N ATOM 1841 CA GLY A 130 -21.582 47.677 -17.743 1.00 37.79 C ATOM 1842 C GLY A 130 -21.356 47.906 -16.265 1.00 38.75 C ATOM 1843 O GLY A 130 -20.704 48.870 -15.871 1.00 36.54 O ATOM 1844 HA3 GLY A 130 -22.132 46.743 -17.861 1.00 0.00 H ATOM 1845 HA2 GLY A 130 -22.183 48.502 -18.125 1.00 0.00 H ATOM 1846 H GLY A 130 -20.229 48.273 -19.318 1.00 0.00 H ATOM 1847 N CYS A 131 -21.951 47.054 -15.437 1.00 36.93 N ATOM 1848 CA CYS A 131 -21.921 47.268 -13.996 1.00 39.80 C ATOM 1849 C CYS A 131 -20.526 47.206 -13.413 1.00 37.67 C ATOM 1850 O CYS A 131 -20.276 47.753 -12.357 1.00 36.15 O ATOM 1851 CB CYS A 131 -22.832 46.283 -13.278 1.00 41.59 C ATOM 1852 SG CYS A 131 -24.556 46.773 -13.384 1.00 50.13 S ATOM 1853 HA CYS A 131 -22.288 48.282 -13.836 1.00 0.00 H ATOM 1854 HB2 CYS A 131 -22.542 46.234 -12.228 1.00 0.00 H ATOM 1855 HB3 CYS A 131 -22.716 45.299 -13.732 1.00 0.00 H ATOM 1856 H CYS A 131 -22.445 46.224 -15.822 1.00 0.00 H ATOM 1857 N CYS A 132 -19.636 46.474 -14.064 1.00 36.25 N ATOM 1858 CA CYS A 132 -18.274 46.382 -13.577 1.00 42.40 C ATOM 1859 C CYS A 132 -17.532 47.675 -13.791 1.00 38.67 C ATOM 1860 O CYS A 132 -16.660 48.003 -13.008 1.00 38.07 O ATOM 1861 CB CYS A 132 -17.515 45.232 -14.216 1.00 42.67 C ATOM 1862 SG CYS A 132 -18.040 43.623 -13.636 1.00 53.05 S ATOM 1863 HA CYS A 132 -18.337 46.186 -12.507 1.00 0.00 H ATOM 1864 HB2 CYS A 132 -16.455 45.351 -13.992 1.00 0.00 H ATOM 1865 HB3 CYS A 132 -17.665 45.276 -15.295 1.00 0.00 H ATOM 1866 H CYS A 132 -19.914 45.964 -14.926 1.00 0.00 H ATOM 1867 N ASP A 133 -17.822 48.348 -14.870 1.00 37.33 N ATOM 1868 CA ASP A 133 -17.206 49.619 -15.126 1.00 37.44 C ATOM 1869 C ASP A 133 -17.639 50.589 -14.038 1.00 34.45 C ATOM 1870 O ASP A 133 -16.867 51.273 -13.489 1.00 32.99 O ATOM 1871 CB ASP A 133 -17.601 50.139 -16.487 1.00 37.43 C ATOM 1872 CG ASP A 133 -16.530 49.961 -17.520 1.00 41.87 C ATOM 1873 OD1 ASP A 133 -15.370 49.886 -17.170 1.00 45.55 O ATOM 1874 OD2 ASP A 133 -16.874 49.922 -18.698 1.00 46.85 O ATOM 1875 HA ASP A 133 -16.121 49.511 -15.117 1.00 0.00 H ATOM 1876 HB2 ASP A 133 -18.493 49.606 -16.817 1.00 0.00 H ATOM 1877 HB3 ASP A 133 -17.826 51.202 -16.400 1.00 0.00 H ATOM 1878 H ASP A 133 -18.506 47.960 -15.551 1.00 0.00 H ATOM 1879 N THR A 134 -18.913 50.608 -13.740 1.00 35.65 N ATOM 1880 CA THR A 134 -19.423 51.473 -12.691 1.00 30.60 C ATOM 1881 C THR A 134 -18.767 51.186 -11.340 1.00 34.18 C ATOM 1882 O THR A 134 -18.544 52.100 -10.548 1.00 33.48 O ATOM 1883 CB THR A 134 -20.958 51.356 -12.550 1.00 33.51 C ATOM 1884 OG1 THR A 134 -21.582 51.645 -13.808 1.00 38.05 O ATOM 1885 CG2 THR A 134 -21.471 52.319 -11.499 1.00 33.65 C ATOM 1886 HA THR A 134 -19.171 52.490 -12.990 1.00 0.00 H ATOM 1887 HB THR A 134 -21.202 50.339 -12.244 1.00 0.00 H ATOM 1888 HG1 THR A 134 -22.564 51.569 -13.713 1.00 0.00 H ATOM 1889 HG23 THR A 134 -20.996 52.098 -10.543 1.00 0.00 H ATOM 1890 HG21 THR A 134 -21.234 53.340 -11.797 1.00 0.00 H ATOM 1891 HG22 THR A 134 -22.551 52.209 -11.403 1.00 0.00 H ATOM 1892 H THR A 134 -19.570 49.994 -14.262 1.00 0.00 H ATOM 1893 N LYS A 135 -18.559 49.911 -11.031 1.00 29.53 N ATOM 1894 CA LYS A 135 -18.026 49.535 -9.723 1.00 30.07 C ATOM 1895 C LYS A 135 -16.543 49.869 -9.667 1.00 28.73 C ATOM 1896 O LYS A 135 -16.034 50.359 -8.651 1.00 29.01 O ATOM 1897 CB LYS A 135 -18.258 48.044 -9.456 1.00 27.49 C ATOM 1898 CG LYS A 135 -17.586 47.506 -8.198 1.00 34.69 C ATOM 1899 CD LYS A 135 -18.311 47.961 -6.936 1.00 31.29 C ATOM 1900 CE LYS A 135 -17.550 47.494 -5.689 1.00 32.53 C ATOM 1901 NZ LYS A 135 -18.360 47.817 -4.465 1.00 28.86 N ATOM 1902 HA LYS A 135 -18.546 50.098 -8.948 1.00 0.00 H ATOM 1903 HB2 LYS A 135 -19.332 47.879 -9.364 1.00 0.00 H ATOM 1904 HB3 LYS A 135 -17.877 47.483 -10.310 1.00 0.00 H ATOM 1905 HG2 LYS A 135 -17.588 46.417 -8.234 1.00 0.00 H ATOM 1906 HG3 LYS A 135 -16.558 47.866 -8.165 1.00 0.00 H ATOM 1907 HD2 LYS A 135 -18.377 49.049 -6.931 1.00 0.00 H ATOM 1908 HD3 LYS A 135 -19.315 47.537 -6.925 1.00 0.00 H ATOM 1909 HE2 LYS A 135 -16.589 48.005 -5.636 1.00 0.00 H ATOM 1910 HE3 LYS A 135 -17.385 46.418 -5.744 1.00 0.00 H ATOM 1911 HZ1 LYS A 135 -18.516 48.844 -4.415 1.00 0.00 H ATOM 1912 HZ2 LYS A 135 -19.276 47.328 -4.518 1.00 0.00 H ATOM 1913 HZ3 LYS A 135 -17.846 47.501 -3.618 1.00 0.00 H ATOM 1914 H LYS A 135 -18.778 49.171 -11.728 1.00 0.00 H ATOM 1915 N PHE A 136 -15.841 49.557 -10.750 1.00 27.99 N ATOM 1916 CA PHE A 136 -14.404 49.814 -10.797 1.00 28.47 C ATOM 1917 C PHE A 136 -14.131 51.316 -10.660 1.00 28.00 C ATOM 1918 O PHE A 136 -13.260 51.735 -9.873 1.00 31.35 O ATOM 1919 CB PHE A 136 -13.790 49.223 -12.086 1.00 29.65 C ATOM 1920 CG PHE A 136 -12.321 49.530 -12.252 1.00 31.89 C ATOM 1921 CD1 PHE A 136 -11.376 48.852 -11.495 1.00 31.60 C ATOM 1922 CD2 PHE A 136 -11.903 50.572 -13.066 1.00 32.00 C ATOM 1923 CE1 PHE A 136 -10.015 49.158 -11.589 1.00 30.54 C ATOM 1924 CE2 PHE A 136 -10.544 50.896 -13.163 1.00 36.44 C ATOM 1925 CZ PHE A 136 -9.605 50.172 -12.416 1.00 28.30 C ATOM 1926 HA PHE A 136 -13.922 49.316 -9.956 1.00 0.00 H ATOM 1927 HB2 PHE A 136 -13.916 48.141 -12.063 1.00 0.00 H ATOM 1928 HB3 PHE A 136 -14.327 49.632 -12.942 1.00 0.00 H ATOM 1929 HD2 PHE A 136 -12.637 51.143 -13.634 1.00 0.00 H ATOM 1930 HE2 PHE A 136 -10.219 51.706 -13.815 1.00 0.00 H ATOM 1931 HZ PHE A 136 -8.545 50.416 -12.493 1.00 0.00 H ATOM 1932 HE1 PHE A 136 -9.285 48.594 -11.009 1.00 0.00 H ATOM 1933 HD1 PHE A 136 -11.701 48.066 -10.814 1.00 0.00 H ATOM 1934 H PHE A 136 -16.317 49.127 -11.569 1.00 0.00 H ATOM 1935 N ALA A 137 -14.936 52.126 -11.335 1.00 36.24 N ATOM 1936 CA ALA A 137 -14.849 53.589 -11.193 1.00 37.86 C ATOM 1937 C ALA A 137 -15.079 54.030 -9.762 1.00 40.09 C ATOM 1938 O ALA A 137 -14.357 54.888 -9.253 1.00 40.43 O ATOM 1939 CB ALA A 137 -15.830 54.304 -12.135 1.00 38.14 C ATOM 1940 HA ALA A 137 -13.835 53.872 -11.474 1.00 0.00 H ATOM 1941 HB1 ALA A 137 -15.597 54.042 -13.167 1.00 0.00 H ATOM 1942 HB2 ALA A 137 -16.848 53.993 -11.901 1.00 0.00 H ATOM 1943 HB3 ALA A 137 -15.738 55.382 -12.003 1.00 0.00 H ATOM 1944 H ALA A 137 -15.644 51.719 -11.979 1.00 0.00 H ATOM 1945 N GLN A 138 -16.068 53.438 -9.092 1.00 41.17 N ATOM 1946 CA GLN A 138 -16.304 53.782 -7.690 1.00 37.60 C ATOM 1947 C GLN A 138 -15.102 53.531 -6.803 1.00 36.29 C ATOM 1948 O GLN A 138 -14.755 54.377 -5.990 1.00 39.92 O ATOM 1949 CB GLN A 138 -17.535 53.069 -7.121 1.00 36.16 C ATOM 1950 CG GLN A 138 -18.783 53.911 -7.163 1.00 47.01 C ATOM 1951 CD GLN A 138 -20.012 53.173 -6.666 1.00 61.31 C ATOM 1952 OE1 GLN A 138 -19.823 52.297 -5.682 1.00 65.72 O ATOM 1953 NE2 GLN A 138 -21.109 53.342 -7.205 1.00 42.68 N ATOM 1954 HA GLN A 138 -16.492 54.856 -7.688 1.00 0.00 H ATOM 1955 HB2 GLN A 138 -17.709 52.163 -7.701 1.00 0.00 H ATOM 1956 HB3 GLN A 138 -17.332 52.802 -6.084 1.00 0.00 H ATOM 1957 HG2 GLN A 138 -18.630 54.791 -6.539 1.00 0.00 H ATOM 1958 HG3 GLN A 138 -18.957 54.223 -8.193 1.00 0.00 H ATOM 1959 HE22 GLN A 138 -21.210 54.038 -7.971 1.00 0.00 H ATOM 1960 HE21 GLN A 138 -21.932 52.788 -6.893 1.00 0.00 H ATOM 1961 H GLN A 138 -16.670 52.734 -9.565 1.00 0.00 H ATOM 1962 N VAL A 139 -14.592 52.303 -6.812 1.00 36.60 N ATOM 1963 CA VAL A 139 -13.498 51.952 -5.916 1.00 34.55 C ATOM 1964 C VAL A 139 -12.159 52.567 -6.301 1.00 37.17 C ATOM 1965 O VAL A 139 -11.327 52.833 -5.442 1.00 44.84 O ATOM 1966 CB VAL A 139 -13.361 50.424 -5.700 1.00 35.49 C ATOM 1967 CG1 VAL A 139 -14.631 49.881 -5.076 1.00 31.26 C ATOM 1968 CG2 VAL A 139 -13.027 49.675 -7.036 1.00 35.84 C ATOM 1969 HA VAL A 139 -13.782 52.399 -4.963 1.00 0.00 H ATOM 1970 HB VAL A 139 -12.526 50.248 -5.021 1.00 0.00 H ATOM 1971 HG11 VAL A 139 -14.800 50.369 -4.116 1.00 0.00 H ATOM 1972 HG12 VAL A 139 -15.473 50.079 -5.739 1.00 0.00 H ATOM 1973 HG13 VAL A 139 -14.530 48.806 -4.926 1.00 0.00 H ATOM 1974 HG21 VAL A 139 -13.825 49.849 -7.758 1.00 0.00 H ATOM 1975 HG22 VAL A 139 -12.085 50.051 -7.436 1.00 0.00 H ATOM 1976 HG23 VAL A 139 -12.940 48.606 -6.840 1.00 0.00 H ATOM 1977 H VAL A 139 -14.976 51.589 -7.463 1.00 0.00 H ATOM 1978 N ALA A 140 -11.954 52.790 -7.591 1.00 35.40 N ATOM 1979 CA ALA A 140 -10.681 53.298 -8.082 1.00 41.83 C ATOM 1980 C ALA A 140 -10.561 54.766 -7.716 1.00 42.07 C ATOM 1981 O ALA A 140 -9.472 55.247 -7.395 1.00 41.03 O ATOM 1982 CB ALA A 140 -10.571 53.114 -9.591 1.00 42.49 C ATOM 1983 HA ALA A 140 -9.868 52.739 -7.619 1.00 0.00 H ATOM 1984 HB1 ALA A 140 -10.644 52.054 -9.833 1.00 0.00 H ATOM 1985 HB2 ALA A 140 -11.379 53.656 -10.082 1.00 0.00 H ATOM 1986 HB3 ALA A 140 -9.612 53.501 -9.934 1.00 0.00 H ATOM 1987 H ALA A 140 -12.720 52.598 -8.268 1.00 0.00 H ATOM 1988 N GLY A 141 -11.689 55.470 -7.770 1.00 38.00 N ATOM 1989 CA GLY A 141 -11.733 56.874 -7.372 1.00 46.97 C ATOM 1990 C GLY A 141 -10.894 57.699 -8.322 1.00 42.62 C ATOM 1991 O GLY A 141 -10.921 57.474 -9.534 1.00 44.68 O ATOM 1992 HA3 GLY A 141 -11.342 56.977 -6.360 1.00 0.00 H ATOM 1993 HA2 GLY A 141 -12.764 57.227 -7.399 1.00 0.00 H ATOM 1994 H GLY A 141 -12.560 55.009 -8.104 1.00 0.00 H ATOM 1995 N GLY A 142 -10.039 58.546 -7.762 1.00 41.45 N ATOM 1996 CA GLY A 142 -9.183 59.422 -8.570 1.00 46.02 C ATOM 1997 C GLY A 142 -7.789 58.846 -8.799 1.00 44.05 C ATOM 1998 O GLY A 142 -6.889 59.539 -9.262 1.00 43.54 O ATOM 1999 HA3 GLY A 142 -9.084 60.379 -8.059 1.00 0.00 H ATOM 2000 HA2 GLY A 142 -9.659 59.576 -9.538 1.00 0.00 H ATOM 2001 H GLY A 142 -9.974 58.590 -6.725 1.00 0.00 H ATOM 2002 N ARG A 143 -7.610 57.583 -8.443 1.00 33.58 N ATOM 2003 CA ARG A 143 -6.330 56.887 -8.620 1.00 36.55 C ATOM 2004 C ARG A 143 -6.044 56.683 -10.105 1.00 33.63 C ATOM 2005 O ARG A 143 -6.966 56.466 -10.902 1.00 37.91 O ATOM 2006 CB ARG A 143 -6.376 55.523 -7.935 1.00 33.84 C ATOM 2007 CG ARG A 143 -6.456 55.557 -6.409 1.00 38.62 C ATOM 2008 CD ARG A 143 -6.478 54.131 -5.850 1.00 41.07 C ATOM 2009 NE ARG A 143 -6.602 54.073 -4.392 1.00 40.10 N ATOM 2010 CZ ARG A 143 -7.757 54.173 -3.736 1.00 62.86 C ATOM 2011 NH1 ARG A 143 -8.890 54.417 -4.393 1.00 51.91 N ATOM 2012 NH2 ARG A 143 -7.775 54.090 -2.414 1.00 52.63 N ATOM 2013 HA ARG A 143 -5.543 57.496 -8.175 1.00 0.00 H ATOM 2014 HB2 ARG A 143 -7.251 54.990 -8.306 1.00 0.00 H ATOM 2015 HB3 ARG A 143 -5.475 54.977 -8.212 1.00 0.00 H ATOM 2016 HG2 ARG A 143 -5.589 56.086 -6.014 1.00 0.00 H ATOM 2017 HG3 ARG A 143 -7.365 56.077 -6.107 1.00 0.00 H ATOM 2018 HD2 ARG A 143 -5.551 53.634 -6.137 1.00 0.00 H ATOM 2019 HD3 ARG A 143 -7.324 53.602 -6.289 1.00 0.00 H ATOM 2020 HE ARG A 143 -5.734 53.946 -3.834 1.00 0.00 H ATOM 2021 HH12 ARG A 143 -9.787 54.493 -3.872 1.00 0.00 H ATOM 2022 HH11 ARG A 143 -8.877 54.531 -5.427 1.00 0.00 H ATOM 2023 HH22 ARG A 143 -8.676 54.168 -1.900 1.00 0.00 H ATOM 2024 HH21 ARG A 143 -6.888 53.947 -1.890 1.00 0.00 H ATOM 2025 H ARG A 143 -8.407 57.064 -8.022 1.00 0.00 H ATOM 2026 N PRO A 144 -4.762 56.739 -10.488 1.00 33.73 N ATOM 2027 CA PRO A 144 -4.412 56.476 -11.881 1.00 27.99 C ATOM 2028 C PRO A 144 -4.818 55.067 -12.313 1.00 34.93 C ATOM 2029 O PRO A 144 -4.767 54.139 -11.498 1.00 30.04 O ATOM 2030 CB PRO A 144 -2.888 56.610 -11.886 1.00 34.20 C ATOM 2031 CG PRO A 144 -2.616 57.622 -10.782 1.00 36.19 C ATOM 2032 CD PRO A 144 -3.621 57.260 -9.711 1.00 32.32 C ATOM 2033 HA PRO A 144 -4.919 57.151 -12.571 1.00 0.00 H ATOM 2034 HD3 PRO A 144 -3.223 56.498 -9.041 1.00 0.00 H ATOM 2035 HD2 PRO A 144 -3.909 58.137 -9.131 1.00 0.00 H ATOM 2036 HG3 PRO A 144 -2.776 58.640 -11.138 1.00 0.00 H ATOM 2037 HG2 PRO A 144 -1.597 57.526 -10.408 1.00 0.00 H ATOM 2038 HB2 PRO A 144 -2.412 55.655 -11.665 1.00 0.00 H ATOM 2039 HB3 PRO A 144 -2.532 56.978 -12.848 1.00 0.00 H ATOM 2040 N ILE A 145 -5.314 54.946 -13.545 1.00 33.97 N ATOM 2041 CA ILE A 145 -5.766 53.666 -14.096 1.00 36.68 C ATOM 2042 C ILE A 145 -4.803 53.207 -15.193 1.00 34.27 C ATOM 2043 O ILE A 145 -4.355 54.009 -16.013 1.00 33.25 O ATOM 2044 CB ILE A 145 -7.169 53.775 -14.742 1.00 36.08 C ATOM 2045 CG1 ILE A 145 -8.184 54.434 -13.802 1.00 42.32 C ATOM 2046 CG2 ILE A 145 -7.618 52.413 -15.274 1.00 35.39 C ATOM 2047 CD1 ILE A 145 -8.279 53.805 -12.471 1.00 36.18 C ATOM 2048 HA ILE A 145 -5.801 52.961 -13.266 1.00 0.00 H ATOM 2049 HB ILE A 145 -7.106 54.443 -15.601 1.00 0.00 H ATOM 2050 HG12 ILE A 145 -7.897 55.477 -13.667 1.00 0.00 H ATOM 2051 HG13 ILE A 145 -9.166 54.387 -14.273 1.00 0.00 H ATOM 2052 HD11 ILE A 145 -8.578 52.763 -12.584 1.00 0.00 H ATOM 2053 HD12 ILE A 145 -7.309 53.854 -11.977 1.00 0.00 H ATOM 2054 HD13 ILE A 145 -9.020 54.335 -11.872 1.00 0.00 H ATOM 2055 HG21 ILE A 145 -6.907 52.065 -16.024 1.00 0.00 H ATOM 2056 HG22 ILE A 145 -7.660 51.699 -14.452 1.00 0.00 H ATOM 2057 HG23 ILE A 145 -8.606 52.508 -15.725 1.00 0.00 H ATOM 2058 H ILE A 145 -5.383 55.796 -14.140 1.00 0.00 H ATOM 2059 N HIS A 146 -4.420 51.948 -15.150 1.00 30.70 N ATOM 2060 CA HIS A 146 -3.638 51.347 -16.184 1.00 36.92 C ATOM 2061 C HIS A 146 -4.368 50.325 -16.999 1.00 41.52 C ATOM 2062 O HIS A 146 -4.914 49.392 -16.472 1.00 39.44 O ATOM 2063 CB HIS A 146 -2.396 50.750 -15.606 1.00 38.06 C ATOM 2064 CG HIS A 146 -1.676 51.688 -14.723 1.00 41.74 C ATOM 2065 ND1 HIS A 146 -2.115 51.991 -13.466 1.00 52.02 N ATOM 2066 CD2 HIS A 146 -0.603 52.462 -14.944 1.00 46.37 C ATOM 2067 CE1 HIS A 146 -1.324 52.891 -12.934 1.00 48.98 C ATOM 2068 NE2 HIS A 146 -0.397 53.186 -13.809 1.00 38.50 N ATOM 2069 HA HIS A 146 -3.390 52.153 -16.874 1.00 0.00 H ATOM 2070 HB2 HIS A 146 -2.668 49.866 -15.030 1.00 0.00 H ATOM 2071 HB3 HIS A 146 -1.734 50.460 -16.422 1.00 0.00 H ATOM 2072 HD2 HIS A 146 -0.009 52.504 -15.857 1.00 0.00 H ATOM 2073 HE1 HIS A 146 -1.422 53.319 -11.936 1.00 0.00 H ATOM 2074 H HIS A 146 -4.697 51.369 -14.332 1.00 0.00 H ATOM 2075 N HIS A 147 -4.325 50.492 -18.297 1.00 37.38 N ATOM 2076 CA HIS A 147 -5.079 49.673 -19.189 1.00 39.52 C ATOM 2077 C HIS A 147 -4.293 48.509 -19.750 1.00 41.07 C ATOM 2078 O HIS A 147 -3.536 48.679 -20.653 1.00 44.19 O ATOM 2079 CB HIS A 147 -5.664 50.520 -20.281 1.00 36.53 C ATOM 2080 CG HIS A 147 -6.490 51.631 -19.766 1.00 38.21 C ATOM 2081 ND1 HIS A 147 -7.854 51.575 -19.725 1.00 35.58 N ATOM 2082 CD2 HIS A 147 -6.143 52.801 -19.208 1.00 37.53 C ATOM 2083 CE1 HIS A 147 -8.319 52.677 -19.194 1.00 46.17 C ATOM 2084 NE2 HIS A 147 -7.298 53.436 -18.862 1.00 57.55 N ATOM 2085 HA HIS A 147 -5.885 49.222 -18.610 1.00 0.00 H ATOM 2086 HB2 HIS A 147 -4.849 50.937 -20.873 1.00 0.00 H ATOM 2087 HB3 HIS A 147 -6.286 49.889 -20.916 1.00 0.00 H ATOM 2088 HD2 HIS A 147 -5.129 53.173 -19.060 1.00 0.00 H ATOM 2089 HE1 HIS A 147 -9.371 52.923 -19.052 1.00 0.00 H ATOM 2090 H HIS A 147 -3.723 51.244 -18.689 1.00 0.00 H ATOM 2091 N THR A 148 -4.492 47.329 -19.195 1.00 38.94 N ATOM 2092 CA THR A 148 -3.563 46.217 -19.346 1.00 36.46 C ATOM 2093 C THR A 148 -3.830 45.383 -20.587 1.00 36.41 C ATOM 2094 O THR A 148 -2.985 44.597 -20.991 1.00 41.30 O ATOM 2095 CB THR A 148 -3.628 45.289 -18.111 1.00 44.07 C ATOM 2096 OG1 THR A 148 -3.042 45.954 -16.990 1.00 50.19 O ATOM 2097 CG2 THR A 148 -2.875 43.978 -18.375 1.00 39.38 C ATOM 2098 HA THR A 148 -2.574 46.663 -19.445 1.00 0.00 H ATOM 2099 HB THR A 148 -4.672 45.055 -17.905 1.00 0.00 H ATOM 2100 HG1 THR A 148 -3.083 45.361 -16.198 1.00 0.00 H ATOM 2101 HG23 THR A 148 -3.321 43.470 -19.230 1.00 0.00 H ATOM 2102 HG21 THR A 148 -1.829 44.198 -18.587 1.00 0.00 H ATOM 2103 HG22 THR A 148 -2.942 43.338 -17.495 1.00 0.00 H ATOM 2104 H THR A 148 -5.350 47.186 -18.625 1.00 0.00 H ATOM 2105 N TRP A 149 -5.091 45.344 -20.990 1.00 38.01 N ATOM 2106 CA TRP A 149 -5.504 44.660 -22.206 1.00 37.04 C ATOM 2107 C TRP A 149 -5.579 45.681 -23.312 1.00 36.95 C ATOM 2108 O TRP A 149 -5.939 46.835 -23.068 1.00 35.91 O ATOM 2109 CB TRP A 149 -6.881 44.033 -22.041 1.00 34.39 C ATOM 2110 CG TRP A 149 -7.420 43.486 -23.342 1.00 35.61 C ATOM 2111 CD1 TRP A 149 -7.087 42.297 -23.932 1.00 34.49 C ATOM 2112 CD2 TRP A 149 -8.331 44.139 -24.242 1.00 30.05 C ATOM 2113 NE1 TRP A 149 -7.766 42.156 -25.126 1.00 33.03 N ATOM 2114 CE2 TRP A 149 -8.543 43.266 -25.328 1.00 37.07 C ATOM 2115 CE3 TRP A 149 -9.008 45.362 -24.218 1.00 39.05 C ATOM 2116 CZ2 TRP A 149 -9.428 43.561 -26.352 1.00 36.79 C ATOM 2117 CZ3 TRP A 149 -9.851 45.671 -25.264 1.00 39.97 C ATOM 2118 CH2 TRP A 149 -10.030 44.789 -26.329 1.00 31.19 C ATOM 2119 HA TRP A 149 -4.785 43.872 -22.431 1.00 0.00 H ATOM 2120 HB2 TRP A 149 -6.812 43.219 -21.320 1.00 0.00 H ATOM 2121 HB3 TRP A 149 -7.569 44.791 -21.667 1.00 0.00 H ATOM 2122 HE1 TRP A 149 -7.699 41.340 -25.767 1.00 0.00 H ATOM 2123 HD1 TRP A 149 -6.389 41.569 -23.520 1.00 0.00 H ATOM 2124 HZ2 TRP A 149 -9.636 42.843 -27.145 1.00 0.00 H ATOM 2125 HH2 TRP A 149 -10.665 45.085 -27.164 1.00 0.00 H ATOM 2126 HZ3 TRP A 149 -10.386 46.620 -25.258 1.00 0.00 H ATOM 2127 HE3 TRP A 149 -8.872 46.057 -23.389 1.00 0.00 H ATOM 2128 H TRP A 149 -5.814 45.821 -20.415 1.00 0.00 H ATOM 2129 N GLN A 150 -5.116 45.278 -24.491 1.00 36.05 N ATOM 2130 CA GLN A 150 -5.209 46.080 -25.696 1.00 33.70 C ATOM 2131 C GLN A 150 -5.719 45.194 -26.818 1.00 29.48 C ATOM 2132 O GLN A 150 -5.595 43.979 -26.763 1.00 27.56 O ATOM 2133 CB GLN A 150 -3.842 46.660 -26.080 1.00 40.30 C ATOM 2134 CG GLN A 150 -3.423 47.835 -25.226 1.00 39.85 C ATOM 2135 CD GLN A 150 -4.527 48.867 -25.112 1.00 55.47 C ATOM 2136 OE1 GLN A 150 -4.977 49.376 -26.252 1.00 57.50 O ATOM 2137 NE2 GLN A 150 -5.044 49.122 -24.021 1.00 52.25 N ATOM 2138 HA GLN A 150 -5.890 46.913 -25.522 1.00 0.00 H ATOM 2139 HB2 GLN A 150 -3.093 45.875 -25.978 1.00 0.00 H ATOM 2140 HB3 GLN A 150 -3.885 46.987 -27.119 1.00 0.00 H ATOM 2141 HG2 GLN A 150 -3.171 47.475 -24.228 1.00 0.00 H ATOM 2142 HG3 GLN A 150 -2.546 48.303 -25.674 1.00 0.00 H ATOM 2143 HE22 GLN A 150 -4.659 48.701 -23.152 1.00 0.00 H ATOM 2144 HE21 GLN A 150 -5.865 49.758 -23.971 1.00 0.00 H ATOM 2145 H GLN A 150 -4.665 44.343 -24.552 1.00 0.00 H ATOM 2146 N THR A 151 -6.397 45.804 -27.772 1.00 29.49 N ATOM 2147 CA THR A 151 -6.998 45.080 -28.880 1.00 37.27 C ATOM 2148 C THR A 151 -6.012 44.191 -29.649 1.00 38.45 C ATOM 2149 O THR A 151 -6.422 43.236 -30.322 1.00 38.49 O ATOM 2150 CB THR A 151 -7.696 46.068 -29.829 1.00 33.84 C ATOM 2151 OG1 THR A 151 -8.406 45.345 -30.835 1.00 58.60 O ATOM 2152 CG2 THR A 151 -6.690 46.982 -30.477 1.00 40.37 C ATOM 2153 HA THR A 151 -7.730 44.398 -28.447 1.00 0.00 H ATOM 2154 HB THR A 151 -8.394 46.673 -29.251 1.00 0.00 H ATOM 2155 HG1 THR A 151 -7.770 44.787 -31.349 1.00 0.00 H ATOM 2156 HG23 THR A 151 -6.151 47.532 -29.706 1.00 0.00 H ATOM 2157 HG21 THR A 151 -5.987 46.389 -31.062 1.00 0.00 H ATOM 2158 HG22 THR A 151 -7.207 47.684 -31.131 1.00 0.00 H ATOM 2159 H THR A 151 -6.505 46.838 -27.730 1.00 0.00 H ATOM 2160 N TYR A 152 -4.716 44.486 -29.529 1.00 39.76 N ATOM 2161 CA TYR A 152 -3.668 43.693 -30.181 1.00 39.37 C ATOM 2162 C TYR A 152 -3.314 42.431 -29.402 1.00 39.44 C ATOM 2163 O TYR A 152 -2.507 41.625 -29.868 1.00 38.93 O ATOM 2164 CB TYR A 152 -2.394 44.526 -30.387 1.00 41.69 C ATOM 2165 CG TYR A 152 -1.628 44.792 -29.102 1.00 51.27 C ATOM 2166 CD1 TYR A 152 -1.724 46.018 -28.450 1.00 57.32 C ATOM 2167 CD2 TYR A 152 -0.868 43.793 -28.505 1.00 50.88 C ATOM 2168 CE1 TYR A 152 -1.055 46.252 -27.259 1.00 56.43 C ATOM 2169 CE2 TYR A 152 -0.220 44.006 -27.291 1.00 54.67 C ATOM 2170 CZ TYR A 152 -0.315 45.238 -26.675 1.00 60.23 C ATOM 2171 OH TYR A 152 0.354 45.466 -25.486 1.00 58.83 O ATOM 2172 HA TYR A 152 -4.076 43.393 -31.146 1.00 0.00 H ATOM 2173 HB3 TYR A 152 -2.675 45.483 -30.826 1.00 0.00 H ATOM 2174 HB2 TYR A 152 -1.739 43.991 -31.075 1.00 0.00 H ATOM 2175 HD2 TYR A 152 -0.778 42.824 -28.997 1.00 0.00 H ATOM 2176 HE2 TYR A 152 0.358 43.205 -26.830 1.00 0.00 H ATOM 2177 HE1 TYR A 152 -1.111 47.231 -26.784 1.00 0.00 H ATOM 2178 HD1 TYR A 152 -2.336 46.808 -28.884 1.00 0.00 H ATOM 2179 HH TYR A 152 1.326 45.340 -25.626 1.00 0.00 H ATOM 2180 H TYR A 152 -4.439 45.307 -28.953 1.00 0.00 H ATOM 2181 N CYS A 153 -3.848 42.291 -28.188 1.00 36.06 N ATOM 2182 CA CYS A 153 -3.593 41.094 -27.385 1.00 39.57 C ATOM 2183 C CYS A 153 -4.087 39.838 -28.112 1.00 38.10 C ATOM 2184 O CYS A 153 -5.211 39.807 -28.601 1.00 38.32 O ATOM 2185 CB CYS A 153 -4.292 41.199 -26.015 1.00 40.15 C ATOM 2186 SG CYS A 153 -3.522 42.349 -24.823 1.00 46.61 S ATOM 2187 HA CYS A 153 -2.516 41.019 -27.233 1.00 0.00 H ATOM 2188 HB2 CYS A 153 -4.301 40.206 -25.566 1.00 0.00 H ATOM 2189 HB3 CYS A 153 -5.317 41.529 -26.185 1.00 0.00 H ATOM 2190 H CYS A 153 -4.455 43.044 -27.806 1.00 0.00 H ATOM 2191 N PRO A 154 -3.269 38.774 -28.141 1.00 38.94 N ATOM 2192 CA PRO A 154 -3.771 37.550 -28.761 1.00 44.10 C ATOM 2193 C PRO A 154 -5.001 37.008 -28.021 1.00 46.93 C ATOM 2194 O PRO A 154 -5.320 37.485 -26.924 1.00 51.16 O ATOM 2195 CB PRO A 154 -2.590 36.572 -28.633 1.00 43.42 C ATOM 2196 CG PRO A 154 -1.389 37.429 -28.367 1.00 43.18 C ATOM 2197 CD PRO A 154 -1.913 38.609 -27.594 1.00 35.33 C ATOM 2198 HA PRO A 154 -4.093 37.707 -29.790 1.00 0.00 H ATOM 2199 HD3 PRO A 154 -1.942 38.398 -26.525 1.00 0.00 H ATOM 2200 HD2 PRO A 154 -1.306 39.497 -27.771 1.00 0.00 H ATOM 2201 HG3 PRO A 154 -0.936 37.755 -29.303 1.00 0.00 H ATOM 2202 HG2 PRO A 154 -0.651 36.883 -27.779 1.00 0.00 H ATOM 2203 HB2 PRO A 154 -2.755 35.880 -27.807 1.00 0.00 H ATOM 2204 HB3 PRO A 154 -2.459 36.008 -29.557 1.00 0.00 H ATOM 2205 N PRO A 155 -5.757 36.107 -28.668 1.00 47.69 N ATOM 2206 CA PRO A 155 -6.884 35.441 -28.014 1.00 46.06 C ATOM 2207 C PRO A 155 -6.357 34.505 -26.939 1.00 42.37 C ATOM 2208 O PRO A 155 -5.173 34.169 -26.946 1.00 42.44 O ATOM 2209 CB PRO A 155 -7.521 34.625 -29.148 1.00 47.10 C ATOM 2210 CG PRO A 155 -6.979 35.209 -30.411 1.00 48.02 C ATOM 2211 CD PRO A 155 -5.603 35.674 -30.066 1.00 46.45 C ATOM 2212 HA PRO A 155 -7.582 36.130 -27.538 1.00 0.00 H ATOM 2213 HD3 PRO A 155 -4.880 34.863 -30.151 1.00 0.00 H ATOM 2214 HD2 PRO A 155 -5.295 36.502 -30.704 1.00 0.00 H ATOM 2215 HG3 PRO A 155 -7.595 36.046 -30.741 1.00 0.00 H ATOM 2216 HG2 PRO A 155 -6.942 34.455 -31.197 1.00 0.00 H ATOM 2217 HB2 PRO A 155 -7.244 33.574 -29.064 1.00 0.00 H ATOM 2218 HB3 PRO A 155 -8.607 34.717 -29.121 1.00 0.00 H ATOM 2219 N LEU A 156 -7.211 34.116 -25.999 1.00 40.33 N ATOM 2220 CA LEU A 156 -6.762 33.246 -24.922 1.00 45.66 C ATOM 2221 C LEU A 156 -6.452 31.858 -25.459 1.00 44.99 C ATOM 2222 O LEU A 156 -7.098 31.399 -26.407 1.00 43.75 O ATOM 2223 CB LEU A 156 -7.786 33.181 -23.769 1.00 45.44 C ATOM 2224 CG LEU A 156 -7.983 34.483 -22.983 1.00 39.17 C ATOM 2225 CD1 LEU A 156 -8.943 34.315 -21.802 1.00 42.48 C ATOM 2226 CD2 LEU A 156 -6.649 34.999 -22.500 1.00 46.26 C ATOM 2227 HA LEU A 156 -5.847 33.672 -24.510 1.00 0.00 H ATOM 2228 HB2 LEU A 156 -8.749 32.895 -24.191 1.00 0.00 H ATOM 2229 HB3 LEU A 156 -7.455 32.413 -23.069 1.00 0.00 H ATOM 2230 HG LEU A 156 -8.435 35.207 -23.662 1.00 0.00 H ATOM 2231 HD21 LEU A 156 -6.186 34.254 -21.853 1.00 0.00 H ATOM 2232 HD22 LEU A 156 -6.003 35.190 -23.357 1.00 0.00 H ATOM 2233 HD23 LEU A 156 -6.799 35.924 -21.943 1.00 0.00 H ATOM 2234 HD11 LEU A 156 -9.917 33.994 -22.170 1.00 0.00 H ATOM 2235 HD12 LEU A 156 -8.547 33.565 -21.117 1.00 0.00 H ATOM 2236 HD13 LEU A 156 -9.046 35.267 -21.281 1.00 0.00 H ATOM 2237 H LEU A 156 -8.201 34.433 -26.033 1.00 0.00 H ATOM 2238 N PRO A 157 -5.374 31.246 -24.944 1.00 44.47 N ATOM 2239 CA PRO A 157 -5.031 29.862 -25.262 1.00 46.91 C ATOM 2240 C PRO A 157 -6.175 28.909 -24.899 1.00 48.98 C ATOM 2241 O PRO A 157 -6.456 27.944 -25.610 1.00 54.18 O ATOM 2242 CB PRO A 157 -3.799 29.586 -24.385 1.00 42.42 C ATOM 2243 CG PRO A 157 -3.717 30.730 -23.412 1.00 41.46 C ATOM 2244 CD PRO A 157 -4.367 31.888 -24.085 1.00 44.19 C ATOM 2245 HA PRO A 157 -4.844 29.711 -26.325 1.00 0.00 H ATOM 2246 HD3 PRO A 157 -4.836 32.551 -23.359 1.00 0.00 H ATOM 2247 HD2 PRO A 157 -3.647 32.452 -24.678 1.00 0.00 H ATOM 2248 HG3 PRO A 157 -2.676 30.960 -23.184 1.00 0.00 H ATOM 2249 HG2 PRO A 157 -4.244 30.482 -22.490 1.00 0.00 H ATOM 2250 HB2 PRO A 157 -3.917 28.643 -23.852 1.00 0.00 H ATOM 2251 HB3 PRO A 157 -2.899 29.545 -24.998 1.00 0.00 H ATOM 2252 OXT PRO A 157 -6.905 29.121 -23.930 1.00 47.01 O TER 2253 PRO A 157 HETATM 2254 O HOH 1 -9.375 31.097 -13.060 1.00 30.37 O HETATM 2255 O HOH 2 -11.490 52.313 -2.531 1.00 39.16 O HETATM 2256 O HOH 3 -15.564 36.050 2.835 1.00 40.53 O HETATM 2257 O HOH 4 -6.942 48.776 -27.496 1.00 38.26 O HETATM 2258 O HOH 5 2.407 36.502 -15.202 1.00 45.17 O HETATM 2259 O HOH 6 -6.945 23.352 0.570 1.00 44.68 O HETATM 2260 O HOH 7 -1.099 41.361 -8.020 1.00 36.61 O HETATM 2261 O HOH 8 -3.410 40.695 -9.261 1.00 33.52 O HETATM 2262 O HOH 9 -6.037 39.180 -8.714 1.00 28.07 O HETATM 2263 O HOH 10 -9.027 42.089 -30.055 1.00 41.81 O HETATM 2264 O HOH 11 -9.651 20.755 -2.289 1.00 65.98 O HETATM 2265 O HOH 12 -4.399 36.565 -5.632 1.00 27.11 O HETATM 2266 O HOH 13 -16.487 47.236 -2.500 1.00 36.14 O HETATM 2267 O HOH 14 -3.109 44.463 -10.985 1.00 33.65 O HETATM 2268 O HOH 15 -13.076 55.671 -4.031 1.00 34.94 O HETATM 2269 O HOH 16 5.856 40.495 -26.599 1.00 50.42 O HETATM 2270 O HOH 17 -13.236 46.633 -25.746 1.00 34.88 O HETATM 2271 O HOH 18 -12.929 56.378 -10.900 1.00 34.91 O HETATM 2272 O HOH 19 -19.910 45.591 -4.745 1.00 30.41 O HETATM 2273 O HOH 20 -9.357 26.025 -18.560 1.00 49.27 O HETATM 2274 O HOH 21 -19.872 35.046 -20.807 1.00 48.38 O HETATM 2275 O HOH 22 -12.337 47.769 -28.153 1.00 47.58 O HETATM 2276 O HOH 23 -2.981 44.426 0.738 1.00 42.21 O HETATM 2277 O HOH 24 -9.153 57.741 -11.791 1.00 30.21 O HETATM 2278 O HOH 25 -8.855 26.954 3.436 1.00 52.58 O HETATM 2279 O HOH 26 -0.352 54.383 -10.408 1.00 49.46 O HETATM 2280 O HOH 27 -16.083 31.208 -2.433 1.00 51.30 O HETATM 2281 O HOH 28 -19.850 28.593 -10.540 1.00 44.04 O HETATM 2282 O HOH 29 -1.748 49.327 -3.410 1.00 42.85 O HETATM 2283 O HOH 30 -0.041 48.070 -14.901 1.00 36.18 O HETATM 2284 O HOH 31 -2.952 53.884 -9.188 1.00 35.84 O HETATM 2285 O HOH 32 -24.566 35.992 -2.679 1.00 47.88 O HETATM 2286 O HOH 33 5.046 34.745 -32.510 1.00 45.05 O HETATM 2287 O HOH 34 -11.541 32.802 -13.387 1.00 27.86 O HETATM 2288 O HOH 35 -1.996 43.023 -6.415 1.00 32.27 O HETATM 2289 O HOH 36 -22.313 43.972 -15.263 1.00 62.44 O HETATM 2290 O HOH 37 -4.128 51.217 -6.108 1.00 42.00 O HETATM 2291 O HOH 38 4.675 47.028 -10.602 1.00 41.70 O HETATM 2292 O HOH 39 -16.599 41.056 -1.180 1.00 30.16 O HETATM 2293 O HOH 40 -7.440 41.177 -1.310 1.00 35.97 O HETATM 2294 O HOH 41 -19.063 54.777 -10.934 1.00 34.01 O HETATM 2295 O HOH 42 -19.340 39.986 -0.098 1.00 62.13 O HETATM 2296 O HOH 43 -0.151 40.687 -30.282 1.00 35.87 O HETATM 2297 O HOH 44 -17.063 36.288 -13.146 1.00 57.03 O HETATM 2298 O HOH 45 -13.720 48.923 -1.434 1.00 49.62 O HETATM 2299 O HOH 46 -14.525 52.071 -14.957 1.00 40.18 O HETATM 2300 O HOH 47 -14.059 44.089 0.946 1.00 49.13 O HETATM 2301 O HOH 48 0.842 38.820 -1.297 1.00 39.74 O HETATM 2302 O HOH 49 -11.163 45.154 -32.574 1.00 45.71 O HETATM 2303 O HOH 50 -1.791 52.366 -19.171 1.00 37.45 O HETATM 2304 OH SRO A 51 -8.126 31.785 -10.848 1.00 -0.34 O HETATM 2305 CZ3 SRO A 51 -8.061 33.132 -10.586 1.00 0.07 C HETATM 2306 CH2 SRO A 51 -7.047 33.572 -9.739 1.00 -0.05 C HETATM 2307 CZ2 SRO A 51 -6.851 34.939 -9.527 1.00 -0.05 C HETATM 2308 CE2 SRO A 51 -7.747 35.806 -10.134 1.00 0.05 C HETATM 2309 NE1 SRO A 51 -7.920 37.152 -10.121 1.00 -0.29 N HETATM 2310 CD1 SRO A 51 -8.958 37.478 -10.927 1.00 0.01 C HETATM 2311 CG SRO A 51 -9.498 36.304 -11.454 1.00 -0.05 C HETATM 2312 CD2 SRO A 51 -8.739 35.260 -10.931 1.00 -0.03 C HETATM 2313 CE3 SRO A 51 -8.880 33.975 -11.140 1.00 -0.05 C HETATM 2314 H6 SRO A 51 -9.681 33.614 -11.776 1.00 0.04 H HETATM 2315 CB SRO A 51 -10.695 36.209 -12.368 1.00 0.00 C HETATM 2316 CA SRO A 51 -11.865 35.510 -11.648 1.00 -0.03 C HETATM 2317 NZ SRO A 51 -12.943 35.287 -12.617 1.00 0.22 N HETATM 2318 H11 SRO A 51 -13.716 34.830 -12.160 1.00 0.20 H HETATM 2319 H12 SRO A 51 -12.605 34.705 -13.368 1.00 0.20 H HETATM 2320 H13 SRO A 51 -13.249 36.172 -12.989 1.00 0.20 H HETATM 2321 H9 SRO A 51 -12.229 36.147 -10.828 1.00 0.08 H HETATM 2322 H10 SRO A 51 -11.527 34.546 -11.241 1.00 0.08 H HETATM 2323 H7 SRO A 51 -10.423 35.631 -13.263 1.00 0.04 H HETATM 2324 H8 SRO A 51 -11.005 37.221 -12.666 1.00 0.04 H HETATM 2325 H5 SRO A 51 -9.312 38.488 -11.130 1.00 0.08 H HETATM 2326 H4 SRO A 51 -7.351 37.821 -9.582 1.00 0.22 H HETATM 2327 H3 SRO A 51 -6.035 35.306 -8.915 1.00 0.05 H HETATM 2328 H2 SRO A 51 -6.407 32.851 -9.242 1.00 0.05 H HETATM 2329 H1 SRO A 51 -8.854 31.612 -11.434 1.00 0.24 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 35 34 1852 CONECT 513 512 2186 CONECT 1468 1467 1862 CONECT 1852 35 1851 CONECT 1862 1468 1861 CONECT 2186 513 2185 CONECT 2304 2305 2329 CONECT 2305 2304 2306 2313 CONECT 2306 2305 2307 2328 CONECT 2307 2306 2308 2327 CONECT 2308 2307 2309 2312 CONECT 2309 2308 2310 2326 CONECT 2310 2309 2311 2325 CONECT 2311 2310 2312 2315 CONECT 2312 2308 2311 2313 CONECT 2313 2305 2312 2314 CONECT 2314 2313 CONECT 2315 2311 2316 2323 2324 CONECT 2316 2315 2317 2321 2322 CONECT 2317 2316 2318 2319 2320 CONECT 2318 2317 CONECT 2319 2317 CONECT 2320 2317 CONECT 2321 2316 CONECT 2322 2316 CONECT 2323 2315 CONECT 2324 2315 CONECT 2325 2310 CONECT 2326 2309 CONECT 2327 2307 CONECT 2328 2306 CONECT 2329 2304 MASTER 0 0 0 0 0 0 0 0 2328 1 36 12 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2ymd
RCSB PDB
PDBbind
SRO
3adv
RCSB PDB
PDBbind
SRO
3q6k
RCSB PDB
PDBbind
SRO
Entry Information
PDB ID
3brn
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
AM-182, monotonin
Ligand Name
SRO
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=2nM
Release Year
2008
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) J.Biol.Chem. Vol. 283: pp. 18721-18733
Ligand Properties
Formula
C
1
0
H
1
3
N
2
O
Molecular Weight
177.223
Exact Mass
177.103
No. of atoms
26
No. of bonds
27
Polar Surface Area
63.66
LOGP Value
1.01 (
Computed with XLOGP3
)
0.66 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
[NH3+]CCc1c[nH]c2c1cc(O)cc2
InChI String
InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2/p+1
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):
Q09JR9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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