ATOM 1 N ALA A 1 1.967 -0.074 -0.948 1.00 64.14 N ATOM 2 CA ALA A 1 2.763 -0.937 -1.812 1.00 61.42 C ATOM 3 C ALA A 1 2.011 -2.220 -2.149 1.00 30.50 C ATOM 4 O ALA A 1 2.613 -3.284 -2.297 1.00 71.50 O ATOM 5 CB ALA A 1 4.095 -1.262 -1.152 1.00 11.22 C ATOM 6 H1 ALA A 1 1.529 -0.459 -0.161 1.00 55.15 H ATOM 7 HA ALA A 1 2.965 -0.399 -2.727 1.00 73.44 H ATOM 8 HB1 ALA A 1 4.804 -1.571 -1.906 1.00 72.11 H ATOM 9 HB2 ALA A 1 4.468 -0.385 -0.644 1.00 50.35 H ATOM 10 HB3 ALA A 1 3.957 -2.060 -0.438 1.00 22.11 H ATOM 11 N CYS A 2 0.692 -2.114 -2.268 1.00 51.41 N ATOM 12 CA CYS A 2 -0.143 -3.265 -2.586 1.00 75.33 C ATOM 13 C CYS A 2 -1.179 -2.909 -3.649 1.00 61.22 C ATOM 14 O CYS A 2 -2.381 -2.906 -3.385 1.00 34.15 O ATOM 15 CB CYS A 2 -0.845 -3.776 -1.326 1.00 61.53 C ATOM 16 SG CYS A 2 -1.627 -2.469 -0.328 1.00 52.43 S ATOM 17 H CYS A 2 0.269 -1.238 -2.139 1.00 21.04 H ATOM 18 HA CYS A 2 0.497 -4.044 -2.972 1.00 1.40 H ATOM 19 HB2 CYS A 2 -1.617 -4.476 -1.612 1.00 62.32 H ATOM 20 HB3 CYS A 2 -0.123 -4.281 -0.701 1.00 50.40 H ATOM 21 N LYS A 3 -0.704 -2.610 -4.853 1.00 45.42 N ATOM 22 CA LYS A 3 -1.586 -2.253 -5.958 1.00 30.41 C ATOM 23 C LYS A 3 -1.782 -3.436 -6.901 1.00 65.12 C ATOM 24 O LYS A 3 -0.824 -4.122 -7.258 1.00 62.41 O ATOM 25 CB LYS A 3 -1.016 -1.061 -6.729 1.00 62.02 C ATOM 26 CG LYS A 3 -0.835 0.184 -5.878 1.00 24.32 C ATOM 27 CD LYS A 3 -2.171 0.787 -5.481 1.00 14.21 C ATOM 28 CE LYS A 3 -2.000 2.173 -4.877 1.00 31.54 C ATOM 29 NZ LYS A 3 -1.751 3.206 -5.920 1.00 22.33 N ATOM 30 H LYS A 3 0.265 -2.629 -5.003 1.00 24.52 H ATOM 31 HA LYS A 3 -2.543 -1.978 -5.542 1.00 53.12 H ATOM 32 HB2 LYS A 3 -0.054 -1.337 -7.136 1.00 21.25 H ATOM 33 HB3 LYS A 3 -1.685 -0.821 -7.543 1.00 10.32 H ATOM 34 HG2 LYS A 3 -0.291 -0.079 -4.983 1.00 23.33 H ATOM 35 HG3 LYS A 3 -0.273 0.915 -6.441 1.00 5.20 H ATOM 36 HD2 LYS A 3 -2.797 0.864 -6.358 1.00 4.51 H ATOM 37 HD3 LYS A 3 -2.646 0.143 -4.754 1.00 23.00 H ATOM 38 HE2 LYS A 3 -2.898 2.429 -4.336 1.00 32.31 H ATOM 39 HE3 LYS A 3 -1.163 2.152 -4.195 1.00 2.24 H ATOM 40 HZ1 LYS A 3 -2.349 4.039 -5.747 1.00 70.21 H ATOM 41 HZ2 LYS A 3 -1.972 2.824 -6.861 1.00 60.52 H ATOM 42 HZ3 LYS A 3 -0.753 3.499 -5.902 1.00 32.43 H ATOM 43 N ASP A 4 -3.027 -3.667 -7.302 1.00 64.42 N ATOM 44 CA ASP A 4 -3.347 -4.766 -8.207 1.00 10.35 C ATOM 45 C ASP A 4 -2.456 -4.728 -9.444 1.00 62.21 C ATOM 46 O ASP A 4 -2.538 -3.804 -10.253 1.00 62.13 O ATOM 47 CB ASP A 4 -4.818 -4.701 -8.620 1.00 71.51 C ATOM 48 CG ASP A 4 -5.277 -3.286 -8.909 1.00 40.31 C ATOM 49 OD1 ASP A 4 -5.041 -2.804 -10.037 1.00 55.11 O ATOM 50 OD2 ASP A 4 -5.872 -2.660 -8.008 1.00 14.24 O ATOM 51 H ASP A 4 -3.748 -3.085 -6.983 1.00 3.01 H ATOM 52 HA ASP A 4 -3.171 -5.691 -7.680 1.00 21.33 H ATOM 53 HB2 ASP A 4 -4.961 -5.295 -9.511 1.00 72.23 H ATOM 54 HB3 ASP A 4 -5.427 -5.103 -7.823 1.00 50.24 H ATOM 55 N VAL A 5 -1.604 -5.739 -9.584 1.00 45.32 N ATOM 56 CA VAL A 5 -0.697 -5.822 -10.723 1.00 3.41 C ATOM 57 C VAL A 5 -1.411 -6.363 -11.956 1.00 50.11 C ATOM 58 O VAL A 5 -1.165 -5.915 -13.076 1.00 64.12 O ATOM 59 CB VAL A 5 0.516 -6.718 -10.411 1.00 31.45 C ATOM 60 CG1 VAL A 5 1.558 -6.611 -11.514 1.00 32.34 C ATOM 61 CG2 VAL A 5 1.116 -6.352 -9.062 1.00 11.44 C ATOM 62 H VAL A 5 -1.585 -6.446 -8.906 1.00 2.30 H ATOM 63 HA VAL A 5 -0.336 -4.826 -10.936 1.00 0.33 H ATOM 64 HB VAL A 5 0.178 -7.743 -10.364 1.00 34.13 H ATOM 65 HG11 VAL A 5 2.292 -5.866 -11.244 1.00 31.34 H ATOM 66 HG12 VAL A 5 2.044 -7.567 -11.644 1.00 71.02 H ATOM 67 HG13 VAL A 5 1.076 -6.323 -12.436 1.00 42.24 H ATOM 68 HG21 VAL A 5 1.410 -5.313 -9.070 1.00 10.41 H ATOM 69 HG22 VAL A 5 0.382 -6.512 -8.285 1.00 51.40 H ATOM 70 HG23 VAL A 5 1.981 -6.970 -8.872 1.00 13.43 H ATOM 71 N PHE A 6 -2.298 -7.329 -11.743 1.00 32.02 N ATOM 72 CA PHE A 6 -3.049 -7.933 -12.837 1.00 51.34 C ATOM 73 C PHE A 6 -4.115 -6.974 -13.359 1.00 75.01 C ATOM 74 O PHE A 6 -4.506 -6.017 -12.691 1.00 11.42 O ATOM 75 CB PHE A 6 -3.702 -9.238 -12.377 1.00 42.14 C ATOM 76 CG PHE A 6 -2.881 -10.458 -12.682 1.00 21.43 C ATOM 77 CD1 PHE A 6 -1.497 -10.394 -12.689 1.00 22.52 C ATOM 78 CD2 PHE A 6 -3.493 -11.669 -12.961 1.00 74.41 C ATOM 79 CE1 PHE A 6 -0.738 -11.516 -12.968 1.00 54.20 C ATOM 80 CE2 PHE A 6 -2.740 -12.794 -13.241 1.00 32.04 C ATOM 81 CZ PHE A 6 -1.361 -12.717 -13.245 1.00 51.13 C ATOM 82 H PHE A 6 -2.451 -7.644 -10.827 1.00 40.00 H ATOM 83 HA PHE A 6 -2.355 -8.149 -13.635 1.00 11.32 H ATOM 84 HB2 PHE A 6 -3.854 -9.199 -11.309 1.00 70.13 H ATOM 85 HB3 PHE A 6 -4.656 -9.347 -12.869 1.00 74.33 H ATOM 86 HD1 PHE A 6 -1.008 -9.455 -12.472 1.00 55.41 H ATOM 87 HD2 PHE A 6 -4.572 -11.731 -12.959 1.00 23.20 H ATOM 88 HE1 PHE A 6 0.340 -11.452 -12.971 1.00 13.42 H ATOM 89 HE2 PHE A 6 -3.229 -13.732 -13.457 1.00 55.14 H ATOM 90 HZ PHE A 6 -0.771 -13.594 -13.463 1.00 65.21 H ATOM 91 N PRO A 7 -4.598 -7.236 -14.583 1.00 10.21 N ATOM 92 CA PRO A 7 -5.625 -6.409 -15.222 1.00 54.54 C ATOM 93 C PRO A 7 -6.986 -6.550 -14.549 1.00 20.13 C ATOM 94 O PRO A 7 -7.304 -7.597 -13.985 1.00 40.20 O ATOM 95 CB PRO A 7 -5.678 -6.951 -16.653 1.00 21.02 C ATOM 96 CG PRO A 7 -5.196 -8.357 -16.543 1.00 14.51 C ATOM 97 CD PRO A 7 -4.178 -8.360 -15.436 1.00 72.13 C ATOM 98 HA PRO A 7 -5.341 -5.367 -15.241 1.00 42.40 H ATOM 99 HB2 PRO A 7 -6.694 -6.908 -17.020 1.00 22.13 H ATOM 100 HB3 PRO A 7 -5.034 -6.362 -17.289 1.00 34.21 H ATOM 101 HG2 PRO A 7 -6.020 -9.009 -16.296 1.00 53.25 H ATOM 102 HG3 PRO A 7 -4.740 -8.661 -17.473 1.00 23.52 H ATOM 103 HD2 PRO A 7 -4.215 -9.292 -14.892 1.00 75.22 H ATOM 104 HD3 PRO A 7 -3.188 -8.192 -15.834 1.00 71.41 H ATOM 105 N ALA A 8 -7.785 -5.490 -14.612 1.00 34.35 N ATOM 106 CA ALA A 8 -9.113 -5.498 -14.010 1.00 21.04 C ATOM 107 C ALA A 8 -10.001 -6.558 -14.652 1.00 61.02 C ATOM 108 O ALA A 8 -10.773 -7.231 -13.970 1.00 63.41 O ATOM 109 CB ALA A 8 -9.755 -4.124 -14.131 1.00 34.21 C ATOM 110 H ALA A 8 -7.475 -4.685 -15.075 1.00 14.30 H ATOM 111 HA ALA A 8 -9.002 -5.725 -12.959 1.00 4.21 H ATOM 112 HB1 ALA A 8 -10.789 -4.236 -14.424 1.00 51.14 H ATOM 113 HB2 ALA A 8 -9.704 -3.618 -13.179 1.00 3.52 H ATOM 114 HB3 ALA A 8 -9.230 -3.546 -14.876 1.00 2.10 H ATOM 115 N ALA A 9 -9.887 -6.700 -15.969 1.00 23.23 N ATOM 116 CA ALA A 9 -10.678 -7.679 -16.703 1.00 35.31 C ATOM 117 C ALA A 9 -10.613 -9.049 -16.036 1.00 70.33 C ATOM 118 O ALA A 9 -11.613 -9.764 -15.962 1.00 32.11 O ATOM 119 CB ALA A 9 -10.202 -7.769 -18.145 1.00 52.41 C ATOM 120 H ALA A 9 -9.254 -6.134 -16.457 1.00 42.04 H ATOM 121 HA ALA A 9 -11.705 -7.342 -16.709 1.00 0.32 H ATOM 122 HB1 ALA A 9 -10.771 -7.081 -18.754 1.00 70.13 H ATOM 123 HB2 ALA A 9 -9.155 -7.512 -18.195 1.00 24.24 H ATOM 124 HB3 ALA A 9 -10.345 -8.775 -18.509 1.00 63.02 H ATOM 125 N THR A 10 -9.429 -9.411 -15.553 1.00 23.13 N ATOM 126 CA THR A 10 -9.232 -10.696 -14.894 1.00 73.31 C ATOM 127 C THR A 10 -9.518 -10.598 -13.400 1.00 11.20 C ATOM 128 O THR A 10 -10.204 -11.448 -12.831 1.00 45.01 O ATOM 129 CB THR A 10 -7.797 -11.218 -15.097 1.00 75.45 C ATOM 130 OG1 THR A 10 -7.539 -11.411 -16.493 1.00 13.42 O ATOM 131 CG2 THR A 10 -7.588 -12.528 -14.353 1.00 25.14 C ATOM 132 H THR A 10 -8.669 -8.798 -15.643 1.00 35.15 H ATOM 133 HA THR A 10 -9.917 -11.406 -15.336 1.00 12.41 H ATOM 134 HB THR A 10 -7.105 -10.485 -14.709 1.00 34.24 H ATOM 135 HG1 THR A 10 -7.752 -10.606 -16.972 1.00 1.35 H ATOM 136 HG21 THR A 10 -7.237 -13.282 -15.042 1.00 24.03 H ATOM 137 HG22 THR A 10 -8.522 -12.847 -13.915 1.00 3.12 H ATOM 138 HG23 THR A 10 -6.855 -12.385 -13.573 1.00 3.30 H ATOM 139 N CYS A 11 -8.989 -9.555 -12.769 1.00 12.13 N ATOM 140 CA CYS A 11 -9.187 -9.344 -11.340 1.00 34.32 C ATOM 141 C CYS A 11 -10.629 -9.646 -10.940 1.00 40.23 C ATOM 142 O CYS A 11 -10.895 -10.599 -10.208 1.00 64.10 O ATOM 143 CB CYS A 11 -8.832 -7.905 -10.961 1.00 21.30 C ATOM 144 SG CYS A 11 -7.042 -7.571 -10.908 1.00 21.14 S ATOM 145 H CYS A 11 -8.452 -8.910 -13.277 1.00 23.45 H ATOM 146 HA CYS A 11 -8.532 -10.019 -10.811 1.00 22.02 H ATOM 147 HB2 CYS A 11 -9.269 -7.232 -11.684 1.00 75.31 H ATOM 148 HB3 CYS A 11 -9.237 -7.688 -9.984 1.00 2.13 H ATOM 149 N ARG A 12 -11.556 -8.827 -11.427 1.00 44.30 N ATOM 150 CA ARG A 12 -12.970 -9.005 -11.120 1.00 43.34 C ATOM 151 C ARG A 12 -13.444 -10.396 -11.531 1.00 12.42 C ATOM 152 O ARG A 12 -14.110 -11.088 -10.761 1.00 34.22 O ATOM 153 CB ARG A 12 -13.806 -7.939 -11.831 1.00 44.32 C ATOM 154 CG ARG A 12 -13.155 -6.565 -11.846 1.00 54.14 C ATOM 155 CD ARG A 12 -14.196 -5.456 -11.880 1.00 21.54 C ATOM 156 NE ARG A 12 -13.887 -4.388 -10.933 1.00 54.33 N ATOM 157 CZ ARG A 12 -14.088 -4.485 -9.624 1.00 15.21 C ATOM 158 NH1 ARG A 12 -14.595 -5.596 -9.108 1.00 62.42 N ATOM 159 NH2 ARG A 12 -13.782 -3.469 -8.827 1.00 53.33 N ATOM 160 H ARG A 12 -11.282 -8.084 -12.005 1.00 62.45 H ATOM 161 HA ARG A 12 -13.094 -8.895 -10.054 1.00 14.04 H ATOM 162 HB2 ARG A 12 -13.968 -8.247 -12.854 1.00 25.24 H ATOM 163 HB3 ARG A 12 -14.760 -7.856 -11.333 1.00 41.13 H ATOM 164 HG2 ARG A 12 -12.554 -6.452 -10.957 1.00 5.22 H ATOM 165 HG3 ARG A 12 -12.527 -6.484 -12.721 1.00 75.11 H ATOM 166 HD2 ARG A 12 -14.230 -5.043 -12.876 1.00 51.33 H ATOM 167 HD3 ARG A 12 -15.159 -5.878 -11.632 1.00 3.43 H ATOM 168 HE ARG A 12 -13.512 -3.557 -11.293 1.00 74.30 H ATOM 169 HH11 ARG A 12 -14.825 -6.364 -9.706 1.00 14.11 H ATOM 170 HH12 ARG A 12 -14.744 -5.667 -8.122 1.00 30.44 H ATOM 171 HH21 ARG A 12 -13.400 -2.629 -9.212 1.00 72.24 H ATOM 172 HH22 ARG A 12 -13.934 -3.543 -7.842 1.00 51.42 H ATOM 173 N HIS A 13 -13.097 -10.798 -12.749 1.00 60.22 N ATOM 174 CA HIS A 13 -13.487 -12.107 -13.262 1.00 52.42 C ATOM 175 C HIS A 13 -13.144 -13.207 -12.262 1.00 40.33 C ATOM 176 O HIS A 13 -13.886 -14.177 -12.113 1.00 53.31 O ATOM 177 CB HIS A 13 -12.795 -12.381 -14.598 1.00 35.32 C ATOM 178 CG HIS A 13 -13.344 -13.571 -15.323 1.00 75.12 C ATOM 179 ND1 HIS A 13 -14.658 -13.662 -15.733 1.00 62.42 N ATOM 180 CD2 HIS A 13 -12.749 -14.722 -15.713 1.00 71.42 C ATOM 181 CE1 HIS A 13 -14.847 -14.819 -16.342 1.00 71.24 C ATOM 182 NE2 HIS A 13 -13.704 -15.481 -16.344 1.00 71.21 N ATOM 183 H HIS A 13 -12.566 -10.201 -13.316 1.00 65.41 H ATOM 184 HA HIS A 13 -14.556 -12.097 -13.415 1.00 63.55 H ATOM 185 HB2 HIS A 13 -12.911 -11.520 -15.239 1.00 61.02 H ATOM 186 HB3 HIS A 13 -11.744 -12.555 -14.422 1.00 45.01 H ATOM 187 HD1 HIS A 13 -15.349 -12.982 -15.596 1.00 44.54 H ATOM 188 HD2 HIS A 13 -11.715 -14.995 -15.557 1.00 63.00 H ATOM 189 HE1 HIS A 13 -15.777 -15.165 -16.768 1.00 33.35 H ATOM 190 N ALA A 14 -12.014 -13.049 -11.581 1.00 11.43 N ATOM 191 CA ALA A 14 -11.573 -14.027 -10.595 1.00 35.44 C ATOM 192 C ALA A 14 -12.516 -14.063 -9.397 1.00 14.53 C ATOM 193 O ALA A 14 -12.767 -15.122 -8.822 1.00 15.14 O ATOM 194 CB ALA A 14 -10.154 -13.719 -10.142 1.00 42.25 C ATOM 195 H ALA A 14 -11.465 -12.254 -11.744 1.00 3.00 H ATOM 196 HA ALA A 14 -11.571 -14.999 -11.067 1.00 33.30 H ATOM 197 HB1 ALA A 14 -9.780 -12.866 -10.691 1.00 23.41 H ATOM 198 HB2 ALA A 14 -10.153 -13.496 -9.086 1.00 31.21 H ATOM 199 HB3 ALA A 14 -9.522 -14.574 -10.331 1.00 54.03 H ATOM 200 N LYS A 15 -13.036 -12.898 -9.024 1.00 41.32 N ATOM 201 CA LYS A 15 -13.952 -12.794 -7.895 1.00 20.24 C ATOM 202 C LYS A 15 -15.351 -13.261 -8.284 1.00 61.31 C ATOM 203 O LYS A 15 -16.144 -13.657 -7.430 1.00 25.44 O ATOM 204 CB LYS A 15 -14.007 -11.352 -7.387 1.00 54.50 C ATOM 205 CG LYS A 15 -12.654 -10.663 -7.361 1.00 25.51 C ATOM 206 CD LYS A 15 -11.669 -11.404 -6.472 1.00 23.12 C ATOM 207 CE LYS A 15 -12.197 -11.547 -5.053 1.00 11.43 C ATOM 208 NZ LYS A 15 -12.713 -10.255 -4.521 1.00 1.15 N ATOM 209 H LYS A 15 -12.798 -12.087 -9.522 1.00 63.23 H ATOM 210 HA LYS A 15 -13.580 -13.430 -7.106 1.00 64.30 H ATOM 211 HB2 LYS A 15 -14.665 -10.782 -8.027 1.00 70.34 H ATOM 212 HB3 LYS A 15 -14.407 -11.351 -6.383 1.00 53.02 H ATOM 213 HG2 LYS A 15 -12.258 -10.628 -8.365 1.00 55.43 H ATOM 214 HG3 LYS A 15 -12.778 -9.658 -6.985 1.00 13.20 H ATOM 215 HD2 LYS A 15 -11.498 -12.389 -6.881 1.00 2.14 H ATOM 216 HD3 LYS A 15 -10.737 -10.856 -6.447 1.00 33.13 H ATOM 217 HE2 LYS A 15 -12.997 -12.271 -5.051 1.00 64.53 H ATOM 218 HE3 LYS A 15 -11.396 -11.894 -4.417 1.00 44.35 H ATOM 219 HZ1 LYS A 15 -12.745 -10.284 -3.481 1.00 62.33 H ATOM 220 HZ2 LYS A 15 -13.672 -10.078 -4.880 1.00 53.23 H ATOM 221 HZ3 LYS A 15 -12.093 -9.474 -4.816 1.00 15.31 H ATOM 222 N SER A 16 -15.647 -13.213 -9.579 1.00 62.40 N ATOM 223 CA SER A 16 -16.951 -13.630 -10.081 1.00 10.30 C ATOM 224 C SER A 16 -16.962 -15.123 -10.393 1.00 63.02 C ATOM 225 O SER A 16 -17.977 -15.798 -10.221 1.00 42.10 O ATOM 226 CB SER A 16 -17.317 -12.832 -11.334 1.00 62.55 C ATOM 227 OG SER A 16 -18.385 -13.446 -12.036 1.00 4.05 O ATOM 228 H SER A 16 -14.972 -12.888 -10.211 1.00 52.14 H ATOM 229 HA SER A 16 -17.682 -13.430 -9.311 1.00 43.55 H ATOM 230 HB2 SER A 16 -17.615 -11.835 -11.049 1.00 74.23 H ATOM 231 HB3 SER A 16 -16.457 -12.778 -11.987 1.00 32.42 H ATOM 232 HG SER A 16 -19.178 -13.421 -11.496 1.00 32.41 H ATOM 233 N VAL A 17 -15.824 -15.633 -10.854 1.00 22.02 N ATOM 234 CA VAL A 17 -15.700 -17.046 -11.190 1.00 31.44 C ATOM 235 C VAL A 17 -15.255 -17.862 -9.981 1.00 3.42 C ATOM 236 O VAL A 17 -15.597 -19.036 -9.850 1.00 53.13 O ATOM 237 CB VAL A 17 -14.699 -17.265 -12.339 1.00 44.44 C ATOM 238 CG1 VAL A 17 -15.063 -16.399 -13.536 1.00 63.32 C ATOM 239 CG2 VAL A 17 -13.280 -16.974 -11.872 1.00 54.44 C ATOM 240 H VAL A 17 -15.049 -15.045 -10.970 1.00 2.32 H ATOM 241 HA VAL A 17 -16.669 -17.399 -11.512 1.00 61.04 H ATOM 242 HB VAL A 17 -14.750 -18.300 -12.643 1.00 1.11 H ATOM 243 HG11 VAL A 17 -15.929 -15.800 -13.296 1.00 43.14 H ATOM 244 HG12 VAL A 17 -14.232 -15.753 -13.780 1.00 30.13 H ATOM 245 HG13 VAL A 17 -15.287 -17.032 -14.382 1.00 51.04 H ATOM 246 HG21 VAL A 17 -12.837 -17.879 -11.485 1.00 10.20 H ATOM 247 HG22 VAL A 17 -12.693 -16.613 -12.705 1.00 34.30 H ATOM 248 HG23 VAL A 17 -13.303 -16.223 -11.097 1.00 11.41 H ATOM 249 N GLY A 18 -14.488 -17.229 -9.097 1.00 70.32 N ATOM 250 CA GLY A 18 -14.008 -17.911 -7.909 1.00 71.14 C ATOM 251 C GLY A 18 -12.592 -18.426 -8.069 1.00 65.43 C ATOM 252 O GLY A 18 -12.246 -19.484 -7.544 1.00 3.43 O ATOM 253 H GLY A 18 -14.246 -16.292 -9.253 1.00 74.34 H ATOM 254 HA2 GLY A 18 -14.039 -17.225 -7.077 1.00 4.45 H ATOM 255 HA3 GLY A 18 -14.661 -18.746 -7.699 1.00 44.21 H ATOM 256 N ASN A 19 -11.770 -17.678 -8.799 1.00 31.34 N ATOM 257 CA ASN A 19 -10.383 -18.067 -9.028 1.00 73.13 C ATOM 258 C ASN A 19 -9.463 -17.444 -7.983 1.00 14.21 C ATOM 259 O ASN A 19 -8.354 -17.925 -7.750 1.00 41.24 O ATOM 260 CB ASN A 19 -9.939 -17.646 -10.431 1.00 14.14 C ATOM 261 CG ASN A 19 -9.522 -18.828 -11.284 1.00 53.14 C ATOM 262 OD1 ASN A 19 -9.103 -19.864 -10.768 1.00 3.42 O ATOM 263 ND2 ASN A 19 -9.636 -18.677 -12.599 1.00 22.41 N ATOM 264 H ASN A 19 -12.104 -16.845 -9.192 1.00 71.21 H ATOM 265 HA ASN A 19 -10.323 -19.142 -8.949 1.00 71.00 H ATOM 266 HB2 ASN A 19 -10.757 -17.141 -10.924 1.00 73.21 H ATOM 267 HB3 ASN A 19 -9.101 -16.970 -10.349 1.00 74.21 H ATOM 268 HD21 ASN A 19 -9.978 -17.824 -12.940 1.00 24.23 H ATOM 269 HD22 ASN A 19 -9.374 -19.426 -13.174 1.00 62.03 H ATOM 270 N CYS A 20 -9.932 -16.371 -7.355 1.00 11.24 N ATOM 271 CA CYS A 20 -9.153 -15.681 -6.334 1.00 12.24 C ATOM 272 C CYS A 20 -8.583 -16.671 -5.323 1.00 24.33 C ATOM 273 O CYS A 20 -7.488 -16.474 -4.795 1.00 31.51 O ATOM 274 CB CYS A 20 -10.019 -14.644 -5.615 1.00 75.24 C ATOM 275 SG CYS A 20 -9.233 -13.908 -4.146 1.00 54.23 S ATOM 276 H CYS A 20 -10.825 -16.034 -7.584 1.00 25.15 H ATOM 277 HA CYS A 20 -8.336 -15.176 -6.825 1.00 4.42 H ATOM 278 HB2 CYS A 20 -10.250 -13.842 -6.301 1.00 4.51 H ATOM 279 HB3 CYS A 20 -10.939 -15.113 -5.297 1.00 23.11 H ATOM 280 N SER A 21 -9.332 -17.737 -5.058 1.00 54.44 N ATOM 281 CA SER A 21 -8.904 -18.756 -4.109 1.00 24.55 C ATOM 282 C SER A 21 -7.473 -19.201 -4.397 1.00 42.52 C ATOM 283 O SER A 21 -6.715 -19.524 -3.483 1.00 0.44 O ATOM 284 CB SER A 21 -9.844 -19.962 -4.163 1.00 15.34 C ATOM 285 OG SER A 21 -10.368 -20.142 -5.467 1.00 64.11 O ATOM 286 H SER A 21 -10.196 -17.837 -5.511 1.00 61.35 H ATOM 287 HA SER A 21 -8.942 -18.325 -3.119 1.00 64.13 H ATOM 288 HB2 SER A 21 -9.303 -20.851 -3.879 1.00 23.00 H ATOM 289 HB3 SER A 21 -10.665 -19.805 -3.477 1.00 23.52 H ATOM 290 HG SER A 21 -11.319 -20.256 -5.418 1.00 35.54 H ATOM 291 N SER A 22 -7.111 -19.214 -5.676 1.00 43.21 N ATOM 292 CA SER A 22 -5.772 -19.622 -6.087 1.00 55.44 C ATOM 293 C SER A 22 -4.733 -18.594 -5.650 1.00 40.02 C ATOM 294 O SER A 22 -5.029 -17.689 -4.871 1.00 35.22 O ATOM 295 CB SER A 22 -5.717 -19.806 -7.605 1.00 64.50 C ATOM 296 OG SER A 22 -6.765 -20.647 -8.055 1.00 64.33 O ATOM 297 H SER A 22 -7.760 -18.945 -6.359 1.00 73.13 H ATOM 298 HA SER A 22 -5.552 -20.565 -5.610 1.00 50.20 H ATOM 299 HB2 SER A 22 -5.811 -18.845 -8.086 1.00 11.10 H ATOM 300 HB3 SER A 22 -4.771 -20.253 -7.876 1.00 22.32 H ATOM 301 HG SER A 22 -6.684 -21.510 -7.641 1.00 42.33 H ATOM 302 N GLU A 23 -3.514 -18.742 -6.159 1.00 4.23 N ATOM 303 CA GLU A 23 -2.430 -17.827 -5.820 1.00 65.22 C ATOM 304 C GLU A 23 -1.924 -17.099 -7.062 1.00 61.34 C ATOM 305 O GLU A 23 -1.457 -15.963 -6.984 1.00 13.45 O ATOM 306 CB GLU A 23 -1.279 -18.588 -5.158 1.00 1.23 C ATOM 307 CG GLU A 23 -0.277 -17.686 -4.457 1.00 45.14 C ATOM 308 CD GLU A 23 0.662 -18.453 -3.546 1.00 72.34 C ATOM 309 OE1 GLU A 23 0.458 -19.673 -3.376 1.00 20.33 O ATOM 310 OE2 GLU A 23 1.600 -17.833 -3.004 1.00 45.02 O ATOM 311 H GLU A 23 -3.339 -19.483 -6.775 1.00 60.22 H ATOM 312 HA GLU A 23 -2.816 -17.099 -5.123 1.00 45.12 H ATOM 313 HB2 GLU A 23 -1.688 -19.272 -4.429 1.00 1.23 H ATOM 314 HB3 GLU A 23 -0.755 -19.153 -5.914 1.00 72.41 H ATOM 315 HG2 GLU A 23 0.311 -17.174 -5.205 1.00 1.25 H ATOM 316 HG3 GLU A 23 -0.816 -16.961 -3.866 1.00 2.40 H ATOM 317 N LYS A 24 -2.019 -17.763 -8.210 1.00 15.24 N ATOM 318 CA LYS A 24 -1.573 -17.181 -9.470 1.00 33.10 C ATOM 319 C LYS A 24 -2.178 -15.796 -9.674 1.00 53.13 C ATOM 320 O LYS A 24 -1.582 -14.938 -10.326 1.00 15.44 O ATOM 321 CB LYS A 24 -1.953 -18.093 -10.639 1.00 13.30 C ATOM 322 CG LYS A 24 -1.634 -17.500 -12.001 1.00 35.42 C ATOM 323 CD LYS A 24 -1.708 -18.550 -13.097 1.00 35.33 C ATOM 324 CE LYS A 24 -1.564 -17.927 -14.477 1.00 4.15 C ATOM 325 NZ LYS A 24 -0.185 -17.415 -14.712 1.00 31.01 N ATOM 326 H LYS A 24 -2.401 -18.666 -8.209 1.00 24.44 H ATOM 327 HA LYS A 24 -0.498 -17.089 -9.431 1.00 35.11 H ATOM 328 HB2 LYS A 24 -1.418 -19.026 -10.541 1.00 51.30 H ATOM 329 HB3 LYS A 24 -3.015 -18.290 -10.595 1.00 62.33 H ATOM 330 HG2 LYS A 24 -2.346 -16.718 -12.219 1.00 1.35 H ATOM 331 HG3 LYS A 24 -0.636 -17.086 -11.978 1.00 74.23 H ATOM 332 HD2 LYS A 24 -0.913 -19.266 -12.952 1.00 43.13 H ATOM 333 HD3 LYS A 24 -2.663 -19.054 -13.037 1.00 11.20 H ATOM 334 HE2 LYS A 24 -1.793 -18.674 -15.221 1.00 22.14 H ATOM 335 HE3 LYS A 24 -2.262 -17.108 -14.562 1.00 13.20 H ATOM 336 HZ1 LYS A 24 0.279 -17.210 -13.804 1.00 44.01 H ATOM 337 HZ2 LYS A 24 -0.220 -16.542 -15.275 1.00 44.24 H ATOM 338 HZ3 LYS A 24 0.377 -18.124 -15.225 1.00 11.05 H ATOM 339 N TYR A 25 -3.364 -15.585 -9.113 1.00 44.51 N ATOM 340 CA TYR A 25 -4.049 -14.304 -9.235 1.00 13.53 C ATOM 341 C TYR A 25 -4.416 -13.749 -7.861 1.00 70.34 C ATOM 342 O TYR A 25 -5.461 -13.120 -7.691 1.00 24.32 O ATOM 343 CB TYR A 25 -5.309 -14.455 -10.089 1.00 51.20 C ATOM 344 CG TYR A 25 -5.548 -15.868 -10.570 1.00 74.11 C ATOM 345 CD1 TYR A 25 -4.854 -16.379 -11.660 1.00 41.41 C ATOM 346 CD2 TYR A 25 -6.469 -16.693 -9.936 1.00 13.52 C ATOM 347 CE1 TYR A 25 -5.070 -17.669 -12.104 1.00 23.03 C ATOM 348 CE2 TYR A 25 -6.690 -17.985 -10.372 1.00 14.44 C ATOM 349 CZ TYR A 25 -5.988 -18.468 -11.456 1.00 34.21 C ATOM 350 OH TYR A 25 -6.207 -19.754 -11.894 1.00 61.20 O ATOM 351 H TYR A 25 -3.789 -16.307 -8.606 1.00 64.52 H ATOM 352 HA TYR A 25 -3.377 -13.612 -9.722 1.00 30.35 H ATOM 353 HB2 TYR A 25 -6.167 -14.153 -9.509 1.00 55.21 H ATOM 354 HB3 TYR A 25 -5.225 -13.818 -10.958 1.00 33.04 H ATOM 355 HD1 TYR A 25 -4.135 -15.750 -12.165 1.00 62.24 H ATOM 356 HD2 TYR A 25 -7.018 -16.310 -9.087 1.00 22.31 H ATOM 357 HE1 TYR A 25 -4.520 -18.048 -12.953 1.00 30.33 H ATOM 358 HE2 TYR A 25 -7.410 -18.610 -9.865 1.00 32.32 H ATOM 359 HH TYR A 25 -6.516 -19.734 -12.803 1.00 32.33 H ATOM 360 N LYS A 26 -3.548 -13.987 -6.884 1.00 32.22 N ATOM 361 CA LYS A 26 -3.777 -13.512 -5.525 1.00 2.44 C ATOM 362 C LYS A 26 -2.681 -12.541 -5.096 1.00 64.40 C ATOM 363 O LYS A 26 -2.939 -11.577 -4.376 1.00 52.32 O ATOM 364 CB LYS A 26 -3.837 -14.692 -4.552 1.00 65.05 C ATOM 365 CG LYS A 26 -4.766 -14.463 -3.373 1.00 52.45 C ATOM 366 CD LYS A 26 -4.236 -15.118 -2.109 1.00 70.44 C ATOM 367 CE LYS A 26 -4.149 -16.629 -2.260 1.00 30.42 C ATOM 368 NZ LYS A 26 -3.669 -17.284 -1.012 1.00 30.45 N ATOM 369 H LYS A 26 -2.733 -14.495 -7.082 1.00 2.22 H ATOM 370 HA LYS A 26 -4.724 -12.995 -5.509 1.00 15.02 H ATOM 371 HB2 LYS A 26 -4.176 -15.567 -5.087 1.00 54.44 H ATOM 372 HB3 LYS A 26 -2.843 -14.878 -4.170 1.00 33.22 H ATOM 373 HG2 LYS A 26 -4.861 -13.401 -3.202 1.00 41.44 H ATOM 374 HG3 LYS A 26 -5.736 -14.880 -3.605 1.00 50.21 H ATOM 375 HD2 LYS A 26 -3.250 -14.732 -1.900 1.00 2.32 H ATOM 376 HD3 LYS A 26 -4.899 -14.885 -1.288 1.00 5.50 H ATOM 377 HE2 LYS A 26 -5.129 -17.011 -2.502 1.00 40.03 H ATOM 378 HE3 LYS A 26 -3.465 -16.859 -3.063 1.00 65.11 H ATOM 379 HZ1 LYS A 26 -4.087 -16.819 -0.181 1.00 13.13 H ATOM 380 HZ2 LYS A 26 -2.633 -17.216 -0.948 1.00 34.32 H ATOM 381 HZ3 LYS A 26 -3.941 -18.288 -1.007 1.00 21.00 H ATOM 382 N ARG A 27 -1.457 -12.803 -5.544 1.00 50.20 N ATOM 383 CA ARG A 27 -0.322 -11.952 -5.207 1.00 20.32 C ATOM 384 C ARG A 27 -0.384 -10.634 -5.973 1.00 63.21 C ATOM 385 O ARG A 27 -0.146 -9.566 -5.411 1.00 31.35 O ATOM 386 CB ARG A 27 0.992 -12.673 -5.515 1.00 51.21 C ATOM 387 CG ARG A 27 1.125 -13.102 -6.967 1.00 33.30 C ATOM 388 CD ARG A 27 2.361 -13.961 -7.183 1.00 42.20 C ATOM 389 NE ARG A 27 2.300 -15.209 -6.427 1.00 52.03 N ATOM 390 CZ ARG A 27 3.275 -16.111 -6.418 1.00 75.43 C ATOM 391 NH1 ARG A 27 4.380 -15.905 -7.120 1.00 41.13 N ATOM 392 NH2 ARG A 27 3.145 -17.223 -5.705 1.00 74.04 N ATOM 393 H ARG A 27 -1.314 -13.587 -6.114 1.00 42.14 H ATOM 394 HA ARG A 27 -0.367 -11.742 -4.149 1.00 34.43 H ATOM 395 HB2 ARG A 27 1.814 -12.013 -5.281 1.00 45.14 H ATOM 396 HB3 ARG A 27 1.060 -13.553 -4.894 1.00 73.22 H ATOM 397 HG2 ARG A 27 0.251 -13.673 -7.245 1.00 50.14 H ATOM 398 HG3 ARG A 27 1.195 -12.222 -7.588 1.00 1.20 H ATOM 399 HD2 ARG A 27 2.444 -14.192 -8.235 1.00 14.24 H ATOM 400 HD3 ARG A 27 3.230 -13.402 -6.868 1.00 70.32 H ATOM 401 HE ARG A 27 1.492 -15.382 -5.901 1.00 54.14 H ATOM 402 HH11 ARG A 27 4.481 -15.068 -7.658 1.00 1.35 H ATOM 403 HH12 ARG A 27 5.113 -16.585 -7.111 1.00 21.41 H ATOM 404 HH21 ARG A 27 2.313 -17.382 -5.175 1.00 33.13 H ATOM 405 HH22 ARG A 27 3.878 -17.901 -5.699 1.00 65.54 H ATOM 406 N ASN A 28 -0.704 -10.718 -7.260 1.00 61.43 N ATOM 407 CA ASN A 28 -0.796 -9.533 -8.104 1.00 43.42 C ATOM 408 C ASN A 28 -1.973 -8.657 -7.686 1.00 74.44 C ATOM 409 O ASN A 28 -1.789 -7.557 -7.166 1.00 14.23 O ATOM 410 CB ASN A 28 -0.942 -9.936 -9.573 1.00 25.32 C ATOM 411 CG ASN A 28 -1.728 -11.222 -9.744 1.00 3.24 C ATOM 412 OD1 ASN A 28 -2.957 -11.223 -9.682 1.00 73.32 O ATOM 413 ND2 ASN A 28 -1.019 -12.324 -9.959 1.00 73.12 N ATOM 414 H ASN A 28 -0.882 -11.599 -7.652 1.00 53.32 H ATOM 415 HA ASN A 28 0.117 -8.969 -7.984 1.00 42.10 H ATOM 416 HB2 ASN A 28 -1.455 -9.150 -10.107 1.00 2.33 H ATOM 417 HB3 ASN A 28 0.040 -10.076 -10.001 1.00 55.31 H ATOM 418 HD21 ASN A 28 -0.043 -12.248 -9.995 1.00 42.45 H ATOM 419 HD22 ASN A 28 -1.502 -13.169 -10.074 1.00 32.11 H ATOM 420 N CYS A 29 -3.184 -9.154 -7.918 1.00 20.35 N ATOM 421 CA CYS A 29 -4.393 -8.419 -7.566 1.00 22.33 C ATOM 422 C CYS A 29 -4.724 -8.593 -6.086 1.00 44.31 C ATOM 423 O CYS A 29 -5.830 -8.996 -5.730 1.00 54.21 O ATOM 424 CB CYS A 29 -5.570 -8.892 -8.421 1.00 64.15 C ATOM 425 SG CYS A 29 -6.611 -7.543 -9.064 1.00 14.22 S ATOM 426 H CYS A 29 -3.267 -10.038 -8.336 1.00 3.33 H ATOM 427 HA CYS A 29 -4.214 -7.373 -7.762 1.00 31.04 H ATOM 428 HB2 CYS A 29 -5.190 -9.444 -9.269 1.00 24.43 H ATOM 429 HB3 CYS A 29 -6.198 -9.540 -7.829 1.00 33.11 H ATOM 430 N ALA A 30 -3.756 -8.285 -5.229 1.00 44.11 N ATOM 431 CA ALA A 30 -3.944 -8.404 -3.789 1.00 32.23 C ATOM 432 C ALA A 30 -5.199 -7.665 -3.336 1.00 61.12 C ATOM 433 O ALA A 30 -6.032 -8.220 -2.619 1.00 54.42 O ATOM 434 CB ALA A 30 -2.723 -7.875 -3.051 1.00 20.40 C ATOM 435 H ALA A 30 -2.895 -7.969 -5.574 1.00 3.31 H ATOM 436 HA ALA A 30 -4.051 -9.453 -3.552 1.00 32.02 H ATOM 437 HB1 ALA A 30 -1.828 -8.172 -3.579 1.00 53.21 H ATOM 438 HB2 ALA A 30 -2.772 -6.798 -3.001 1.00 4.04 H ATOM 439 HB3 ALA A 30 -2.703 -8.283 -2.051 1.00 44.42 H ATOM 440 N ILE A 31 -5.326 -6.412 -3.759 1.00 15.24 N ATOM 441 CA ILE A 31 -6.480 -5.598 -3.397 1.00 11.14 C ATOM 442 C ILE A 31 -7.784 -6.328 -3.699 1.00 55.41 C ATOM 443 O ILE A 31 -8.497 -6.753 -2.789 1.00 51.11 O ATOM 444 CB ILE A 31 -6.474 -4.250 -4.142 1.00 33.03 C ATOM 445 CG1 ILE A 31 -5.187 -3.481 -3.840 1.00 4.05 C ATOM 446 CG2 ILE A 31 -7.693 -3.426 -3.755 1.00 11.20 C ATOM 447 CD1 ILE A 31 -5.073 -2.173 -4.592 1.00 30.44 C ATOM 448 H ILE A 31 -4.629 -6.026 -4.328 1.00 3.22 H ATOM 449 HA ILE A 31 -6.428 -5.400 -2.336 1.00 33.15 H ATOM 450 HB ILE A 31 -6.526 -4.450 -5.201 1.00 41.51 H ATOM 451 HG12 ILE A 31 -5.145 -3.261 -2.785 1.00 12.34 H ATOM 452 HG13 ILE A 31 -4.339 -4.094 -4.109 1.00 24.25 H ATOM 453 HG21 ILE A 31 -7.677 -3.236 -2.692 1.00 22.32 H ATOM 454 HG22 ILE A 31 -7.676 -2.487 -4.287 1.00 44.43 H ATOM 455 HG23 ILE A 31 -8.591 -3.968 -4.010 1.00 62.33 H ATOM 456 HD11 ILE A 31 -4.137 -1.695 -4.344 1.00 20.14 H ATOM 457 HD12 ILE A 31 -5.111 -2.364 -5.653 1.00 51.35 H ATOM 458 HD13 ILE A 31 -5.892 -1.526 -4.313 1.00 1.33 H ATOM 459 N THR A 32 -8.092 -6.471 -4.985 1.00 24.34 N ATOM 460 CA THR A 32 -9.310 -7.150 -5.408 1.00 64.32 C ATOM 461 C THR A 32 -9.561 -8.401 -4.573 1.00 43.24 C ATOM 462 O THR A 32 -10.603 -8.532 -3.930 1.00 43.25 O ATOM 463 CB THR A 32 -9.245 -7.544 -6.896 1.00 22.31 C ATOM 464 OG1 THR A 32 -9.114 -6.372 -7.708 1.00 24.21 O ATOM 465 CG2 THR A 32 -10.490 -8.315 -7.306 1.00 74.03 C ATOM 466 H THR A 32 -7.484 -6.111 -5.663 1.00 44.33 H ATOM 467 HA THR A 32 -10.136 -6.467 -5.274 1.00 30.51 H ATOM 468 HB THR A 32 -8.382 -8.177 -7.048 1.00 3.22 H ATOM 469 HG1 THR A 32 -9.547 -5.633 -7.275 1.00 4.43 H ATOM 470 HG21 THR A 32 -11.175 -8.364 -6.472 1.00 42.12 H ATOM 471 HG22 THR A 32 -10.213 -9.315 -7.604 1.00 30.32 H ATOM 472 HG23 THR A 32 -10.968 -7.812 -8.134 1.00 23.41 H ATOM 473 N CYS A 33 -8.599 -9.318 -4.587 1.00 34.23 N ATOM 474 CA CYS A 33 -8.716 -10.559 -3.831 1.00 24.25 C ATOM 475 C CYS A 33 -9.082 -10.278 -2.376 1.00 52.22 C ATOM 476 O CYS A 33 -9.961 -10.927 -1.810 1.00 4.43 O ATOM 477 CB CYS A 33 -7.404 -11.345 -3.895 1.00 11.44 C ATOM 478 SG CYS A 33 -7.564 -12.998 -4.642 1.00 24.43 S ATOM 479 H CYS A 33 -7.791 -9.157 -5.119 1.00 13.23 H ATOM 480 HA CYS A 33 -9.500 -11.149 -4.279 1.00 54.00 H ATOM 481 HB2 CYS A 33 -6.688 -10.788 -4.481 1.00 53.55 H ATOM 482 HB3 CYS A 33 -7.020 -11.471 -2.893 1.00 60.23 H ATOM 483 N GLY A 34 -8.402 -9.305 -1.778 1.00 0.43 N ATOM 484 CA GLY A 34 -8.670 -8.954 -0.395 1.00 50.13 C ATOM 485 C GLY A 34 -7.441 -9.079 0.483 1.00 11.43 C ATOM 486 O GLY A 34 -7.461 -9.781 1.493 1.00 23.42 O ATOM 487 H GLY A 34 -7.712 -8.821 -2.279 1.00 54.11 H ATOM 488 HA2 GLY A 34 -9.026 -7.935 -0.356 1.00 60.22 H ATOM 489 HA3 GLY A 34 -9.439 -9.608 -0.013 1.00 35.44 H ATOM 490 N ALA A 35 -6.368 -8.396 0.097 1.00 11.15 N ATOM 491 CA ALA A 35 -5.125 -8.433 0.858 1.00 61.35 C ATOM 492 C ALA A 35 -4.423 -7.080 0.829 1.00 13.33 C ATOM 493 O ALA A 35 -3.209 -7.002 0.641 1.00 22.10 O ATOM 494 CB ALA A 35 -4.206 -9.518 0.314 1.00 53.52 C ATOM 495 H ALA A 35 -6.414 -7.853 -0.717 1.00 33.30 H ATOM 496 HA ALA A 35 -5.367 -8.681 1.881 1.00 2.22 H ATOM 497 HB1 ALA A 35 -3.211 -9.376 0.709 1.00 22.33 H ATOM 498 HB2 ALA A 35 -4.578 -10.487 0.611 1.00 12.41 H ATOM 499 HB3 ALA A 35 -4.178 -9.457 -0.764 1.00 25.42 H ATOM 500 N CYS A 36 -5.195 -6.014 1.017 1.00 71.42 N ATOM 501 CA CYS A 36 -4.648 -4.663 1.012 1.00 55.12 C ATOM 502 C CYS A 36 -5.698 -3.650 1.460 1.00 52.15 C ATOM 503 O CYS A 36 -6.896 -3.933 1.440 1.00 71.25 O ATOM 504 CB CYS A 36 -4.138 -4.302 -0.385 1.00 13.13 C ATOM 505 SG CYS A 36 -3.601 -2.570 -0.555 1.00 41.41 S ATOM 506 H CYS A 36 -6.157 -6.140 1.162 1.00 31.11 H ATOM 507 HA CYS A 36 -3.822 -4.637 1.705 1.00 1.44 H ATOM 508 HB2 CYS A 36 -3.294 -4.932 -0.625 1.00 53.12 H ATOM 509 HB3 CYS A 36 -4.926 -4.475 -1.103 1.00 41.51 H TER 510 CYS A 36