HETATM 1 C ACE A 0 12.529 -7.170 3.199 1.00 0.95 C HETATM 2 O ACE A 0 12.892 -6.004 3.371 1.00 0.95 O HETATM 3 CH3 ACE A 0 13.271 -8.310 3.839 1.00 1.17 C HETATM 4 H1 ACE A 0 13.980 -8.710 3.123 1.00 1.49 H HETATM 5 H2 ACE A 0 12.570 -9.077 4.114 1.00 1.66 H HETATM 6 H3 ACE A 0 13.774 -7.944 4.728 1.00 1.58 H ATOM 7 N PRO A 1 11.471 -7.479 2.434 1.00 0.84 N ATOM 8 CA PRO A 1 10.595 -6.463 1.850 1.00 0.69 C ATOM 9 C PRO A 1 9.834 -5.688 2.926 1.00 0.57 C ATOM 10 O PRO A 1 9.644 -6.190 4.036 1.00 0.60 O ATOM 11 CB PRO A 1 9.620 -7.267 0.980 1.00 0.75 C ATOM 12 CG PRO A 1 10.203 -8.633 0.861 1.00 0.91 C ATOM 13 CD PRO A 1 11.037 -8.843 2.089 1.00 0.97 C ATOM 14 HA PRO A 1 11.150 -5.773 1.234 1.00 0.71 H ATOM 15 HB2 PRO A 1 8.651 -7.301 1.458 1.00 0.87 H ATOM 16 HB3 PRO A 1 9.538 -6.815 0.005 1.00 0.76 H ATOM 17 HG2 PRO A 1 9.410 -9.367 0.813 1.00 1.14 H ATOM 18 HG3 PRO A 1 10.824 -8.692 -0.019 1.00 1.06 H ATOM 19 HD2 PRO A 1 10.443 -9.271 2.882 1.00 1.03 H ATOM 20 HD3 PRO A 1 11.886 -9.474 1.867 1.00 1.19 H ATOM 21 N PRO A 2 9.387 -4.462 2.616 1.00 0.51 N ATOM 22 CA PRO A 2 8.648 -3.629 3.568 1.00 0.47 C ATOM 23 C PRO A 2 7.248 -4.171 3.838 1.00 0.42 C ATOM 24 O PRO A 2 6.825 -5.162 3.235 1.00 0.43 O ATOM 25 CB PRO A 2 8.567 -2.259 2.882 1.00 0.50 C ATOM 26 CG PRO A 2 9.446 -2.338 1.679 1.00 0.55 C ATOM 27 CD PRO A 2 9.556 -3.790 1.322 1.00 0.56 C ATOM 28 HA PRO A 2 9.178 -3.534 4.504 1.00 0.52 H ATOM 29 HB2 PRO A 2 7.545 -2.055 2.596 1.00 0.66 H ATOM 30 HB3 PRO A 2 8.925 -1.491 3.549 1.00 0.61 H ATOM 31 HG2 PRO A 2 9.001 -1.783 0.865 1.00 0.72 H ATOM 32 HG3 PRO A 2 10.423 -1.944 1.912 1.00 0.86 H ATOM 33 HD2 PRO A 2 8.771 -4.071 0.635 1.00 0.62 H ATOM 34 HD3 PRO A 2 10.526 -4.001 0.900 1.00 0.79 H ATOM 35 N THR A 3 6.536 -3.522 4.747 1.00 0.45 N ATOM 36 CA THR A 3 5.180 -3.917 5.085 1.00 0.45 C ATOM 37 C THR A 3 4.217 -3.613 3.941 1.00 0.38 C ATOM 38 O THR A 3 3.816 -2.466 3.740 1.00 0.44 O ATOM 39 CB THR A 3 4.711 -3.211 6.367 1.00 0.57 C ATOM 40 OG1 THR A 3 5.262 -1.888 6.420 1.00 0.63 O ATOM 41 CG2 THR A 3 5.127 -3.992 7.602 1.00 0.70 C ATOM 42 H THR A 3 6.933 -2.750 5.206 1.00 0.51 H ATOM 43 HA THR A 3 5.180 -4.982 5.267 1.00 0.50 H ATOM 44 HB THR A 3 3.633 -3.143 6.348 1.00 0.57 H ATOM 45 HG1 THR A 3 4.578 -1.270 6.696 1.00 1.14 H ATOM 46 HG21 THR A 3 4.663 -4.967 7.588 1.00 1.25 H ATOM 47 HG22 THR A 3 4.816 -3.459 8.488 1.00 1.31 H ATOM 48 HG23 THR A 3 6.201 -4.107 7.611 1.00 1.20 H ATOM 49 N LYS A 4 3.864 -4.643 3.187 1.00 0.36 N ATOM 50 CA LYS A 4 3.005 -4.480 2.024 1.00 0.32 C ATOM 51 C LYS A 4 1.535 -4.631 2.392 1.00 0.30 C ATOM 52 O LYS A 4 1.133 -5.623 3.010 1.00 0.37 O ATOM 53 CB LYS A 4 3.391 -5.472 0.936 1.00 0.40 C ATOM 54 CG LYS A 4 3.420 -6.914 1.385 1.00 0.54 C ATOM 55 CD LYS A 4 3.898 -7.788 0.254 1.00 0.91 C ATOM 56 CE LYS A 4 3.747 -9.262 0.580 1.00 1.42 C ATOM 57 NZ LYS A 4 4.330 -10.122 -0.483 1.00 1.96 N ATOM 58 H LYS A 4 4.189 -5.539 3.420 1.00 0.46 H ATOM 59 HA LYS A 4 3.161 -3.490 1.640 1.00 0.33 H ATOM 60 HB2 LYS A 4 2.684 -5.387 0.128 1.00 0.43 H ATOM 61 HB3 LYS A 4 4.373 -5.215 0.567 1.00 0.44 H ATOM 62 HG2 LYS A 4 4.094 -7.014 2.222 1.00 1.02 H ATOM 63 HG3 LYS A 4 2.425 -7.218 1.673 1.00 0.90 H ATOM 64 HD2 LYS A 4 3.314 -7.552 -0.622 1.00 1.39 H ATOM 65 HD3 LYS A 4 4.941 -7.573 0.064 1.00 1.43 H ATOM 66 HE2 LYS A 4 4.249 -9.466 1.512 1.00 1.78 H ATOM 67 HE3 LYS A 4 2.695 -9.491 0.681 1.00 2.07 H ATOM 68 HZ1 LYS A 4 5.339 -9.904 -0.604 1.00 2.37 H ATOM 69 HZ2 LYS A 4 3.840 -9.960 -1.385 1.00 2.18 H ATOM 70 HZ3 LYS A 4 4.233 -11.124 -0.225 1.00 2.55 H ATOM 71 N PRO A 5 0.717 -3.635 2.034 1.00 0.29 N ATOM 72 CA PRO A 5 -0.715 -3.647 2.322 1.00 0.33 C ATOM 73 C PRO A 5 -1.483 -4.582 1.391 1.00 0.33 C ATOM 74 O PRO A 5 -1.005 -4.927 0.305 1.00 0.42 O ATOM 75 CB PRO A 5 -1.130 -2.194 2.099 1.00 0.38 C ATOM 76 CG PRO A 5 -0.149 -1.649 1.118 1.00 0.44 C ATOM 77 CD PRO A 5 1.132 -2.411 1.319 1.00 0.36 C ATOM 78 HA PRO A 5 -0.908 -3.926 3.347 1.00 0.40 H ATOM 79 HB2 PRO A 5 -2.136 -2.157 1.704 1.00 0.47 H ATOM 80 HB3 PRO A 5 -1.070 -1.645 3.025 1.00 0.48 H ATOM 81 HG2 PRO A 5 -0.521 -1.795 0.112 1.00 0.66 H ATOM 82 HG3 PRO A 5 0.015 -0.600 1.308 1.00 0.69 H ATOM 83 HD2 PRO A 5 1.575 -2.658 0.365 1.00 0.48 H ATOM 84 HD3 PRO A 5 1.823 -1.834 1.915 1.00 0.54 H ATOM 85 N THR A 6 -2.669 -4.989 1.820 1.00 0.41 N ATOM 86 CA THR A 6 -3.475 -5.928 1.057 1.00 0.48 C ATOM 87 C THR A 6 -4.064 -5.270 -0.189 1.00 0.36 C ATOM 88 O THR A 6 -4.478 -4.110 -0.160 1.00 0.34 O ATOM 89 CB THR A 6 -4.608 -6.533 1.914 1.00 0.68 C ATOM 90 OG1 THR A 6 -5.336 -7.509 1.159 1.00 0.79 O ATOM 91 CG2 THR A 6 -5.563 -5.457 2.414 1.00 0.74 C ATOM 92 H THR A 6 -3.011 -4.649 2.674 1.00 0.52 H ATOM 93 HA THR A 6 -2.826 -6.733 0.745 1.00 0.53 H ATOM 94 HB THR A 6 -4.162 -7.019 2.766 1.00 0.75 H ATOM 95 HG1 THR A 6 -4.820 -8.323 1.114 1.00 1.10 H ATOM 96 HG21 THR A 6 -5.977 -4.924 1.570 1.00 1.30 H ATOM 97 HG22 THR A 6 -5.027 -4.766 3.048 1.00 1.25 H ATOM 98 HG23 THR A 6 -6.360 -5.918 2.976 1.00 1.26 H ATOM 99 N LYS A 7 -4.083 -6.022 -1.278 1.00 0.36 N ATOM 100 CA LYS A 7 -4.611 -5.537 -2.544 1.00 0.30 C ATOM 101 C LYS A 7 -6.126 -5.373 -2.468 1.00 0.28 C ATOM 102 O LYS A 7 -6.836 -6.289 -2.045 1.00 0.37 O ATOM 103 CB LYS A 7 -4.247 -6.509 -3.668 1.00 0.38 C ATOM 104 CG LYS A 7 -2.757 -6.797 -3.767 1.00 0.52 C ATOM 105 CD LYS A 7 -1.968 -5.548 -4.116 1.00 0.64 C ATOM 106 CE LYS A 7 -0.473 -5.823 -4.189 1.00 0.88 C ATOM 107 NZ LYS A 7 -0.134 -6.870 -5.190 1.00 1.68 N ATOM 108 H LYS A 7 -3.731 -6.937 -1.228 1.00 0.46 H ATOM 109 HA LYS A 7 -4.163 -4.576 -2.747 1.00 0.29 H ATOM 110 HB2 LYS A 7 -4.762 -7.444 -3.501 1.00 0.48 H ATOM 111 HB3 LYS A 7 -4.574 -6.093 -4.609 1.00 0.45 H ATOM 112 HG2 LYS A 7 -2.409 -7.172 -2.817 1.00 0.91 H ATOM 113 HG3 LYS A 7 -2.593 -7.540 -4.532 1.00 0.95 H ATOM 114 HD2 LYS A 7 -2.304 -5.181 -5.072 1.00 1.00 H ATOM 115 HD3 LYS A 7 -2.149 -4.799 -3.358 1.00 0.91 H ATOM 116 HE2 LYS A 7 0.033 -4.909 -4.458 1.00 1.40 H ATOM 117 HE3 LYS A 7 -0.133 -6.146 -3.216 1.00 1.32 H ATOM 118 HZ1 LYS A 7 -0.532 -6.621 -6.120 1.00 2.13 H ATOM 119 HZ2 LYS A 7 -0.517 -7.790 -4.896 1.00 2.29 H ATOM 120 HZ3 LYS A 7 0.899 -6.955 -5.282 1.00 2.09 H ATOM 121 N PRO A 8 -6.643 -4.203 -2.870 1.00 0.30 N ATOM 122 CA PRO A 8 -8.078 -3.923 -2.837 1.00 0.36 C ATOM 123 C PRO A 8 -8.851 -4.650 -3.938 1.00 0.28 C ATOM 124 O PRO A 8 -8.884 -4.208 -5.091 1.00 0.35 O ATOM 125 CB PRO A 8 -8.145 -2.409 -3.035 1.00 0.55 C ATOM 126 CG PRO A 8 -6.912 -2.060 -3.788 1.00 0.73 C ATOM 127 CD PRO A 8 -5.862 -3.051 -3.363 1.00 0.37 C ATOM 128 HA PRO A 8 -8.504 -4.179 -1.879 1.00 0.46 H ATOM 129 HB2 PRO A 8 -9.031 -2.153 -3.603 1.00 0.59 H ATOM 130 HB3 PRO A 8 -8.152 -1.908 -2.081 1.00 0.77 H ATOM 131 HG2 PRO A 8 -7.100 -2.143 -4.849 1.00 1.03 H ATOM 132 HG3 PRO A 8 -6.597 -1.060 -3.535 1.00 1.08 H ATOM 133 HD2 PRO A 8 -5.249 -3.332 -4.204 1.00 0.50 H ATOM 134 HD3 PRO A 8 -5.253 -2.635 -2.574 1.00 0.36 H ATOM 135 N GLY A 9 -9.440 -5.786 -3.587 1.00 0.31 N ATOM 136 CA GLY A 9 -10.265 -6.520 -4.528 1.00 0.37 C ATOM 137 C GLY A 9 -11.737 -6.290 -4.279 1.00 0.47 C ATOM 138 O GLY A 9 -12.411 -5.600 -5.045 1.00 0.51 O ATOM 139 H GLY A 9 -9.320 -6.124 -2.672 1.00 0.41 H ATOM 140 HA2 GLY A 9 -10.027 -6.204 -5.527 1.00 0.39 H ATOM 141 HA3 GLY A 9 -10.054 -7.575 -4.434 1.00 0.47 H ATOM 142 N ASP A 10 -12.225 -6.857 -3.192 1.00 0.62 N ATOM 143 CA ASP A 10 -13.602 -6.638 -2.755 1.00 0.82 C ATOM 144 C ASP A 10 -13.632 -5.499 -1.750 1.00 0.85 C ATOM 145 O ASP A 10 -14.651 -4.842 -1.541 1.00 1.09 O ATOM 146 CB ASP A 10 -14.174 -7.911 -2.124 1.00 1.05 C ATOM 147 CG ASP A 10 -15.581 -7.717 -1.591 1.00 1.81 C ATOM 148 OD1 ASP A 10 -15.735 -7.469 -0.377 1.00 2.41 O ATOM 149 OD2 ASP A 10 -16.540 -7.810 -2.385 1.00 2.32 O ATOM 150 H ASP A 10 -11.644 -7.450 -2.669 1.00 0.65 H ATOM 151 HA ASP A 10 -14.191 -6.366 -3.617 1.00 0.85 H ATOM 152 HB2 ASP A 10 -14.197 -8.694 -2.868 1.00 1.54 H ATOM 153 HB3 ASP A 10 -13.538 -8.217 -1.306 1.00 1.00 H ATOM 154 N ASN A 11 -12.473 -5.250 -1.173 1.00 0.71 N ATOM 155 CA ASN A 11 -12.300 -4.222 -0.162 1.00 0.81 C ATOM 156 C ASN A 11 -11.822 -2.936 -0.813 1.00 0.62 C ATOM 157 O ASN A 11 -11.252 -2.070 -0.163 1.00 0.71 O ATOM 158 CB ASN A 11 -11.301 -4.687 0.905 1.00 1.00 C ATOM 159 CG ASN A 11 -9.932 -5.031 0.339 1.00 1.72 C ATOM 160 OD1 ASN A 11 -9.802 -5.458 -0.810 1.00 2.31 O ATOM 161 ND2 ASN A 11 -8.901 -4.865 1.149 1.00 2.49 N ATOM 162 H ASN A 11 -11.690 -5.772 -1.447 1.00 0.65 H ATOM 163 HA ASN A 11 -13.259 -4.045 0.302 1.00 0.95 H ATOM 164 HB2 ASN A 11 -11.176 -3.901 1.634 1.00 1.31 H ATOM 165 HB3 ASN A 11 -11.695 -5.564 1.395 1.00 1.48 H ATOM 166 HD21 ASN A 11 -9.074 -4.537 2.058 1.00 2.63 H ATOM 167 HD22 ASN A 11 -8.008 -5.079 0.811 1.00 3.19 H ATOM 168 N ALA A 12 -12.066 -2.819 -2.109 1.00 0.42 N ATOM 169 CA ALA A 12 -11.628 -1.662 -2.877 1.00 0.31 C ATOM 170 C ALA A 12 -12.543 -0.457 -2.660 1.00 0.32 C ATOM 171 O ALA A 12 -12.550 0.482 -3.456 1.00 0.40 O ATOM 172 CB ALA A 12 -11.565 -2.013 -4.350 1.00 0.32 C ATOM 173 H ALA A 12 -12.560 -3.533 -2.563 1.00 0.44 H ATOM 174 HA ALA A 12 -10.631 -1.412 -2.549 1.00 0.38 H ATOM 175 HB1 ALA A 12 -11.151 -1.183 -4.902 1.00 1.05 H ATOM 176 HB2 ALA A 12 -12.561 -2.222 -4.708 1.00 0.95 H ATOM 177 HB3 ALA A 12 -10.943 -2.884 -4.488 1.00 1.02 H ATOM 178 N THR A 13 -13.304 -0.491 -1.577 1.00 0.36 N ATOM 179 CA THR A 13 -14.185 0.606 -1.208 1.00 0.43 C ATOM 180 C THR A 13 -13.383 1.879 -0.971 1.00 0.33 C ATOM 181 O THR A 13 -12.231 1.809 -0.555 1.00 0.24 O ATOM 182 CB THR A 13 -14.969 0.263 0.070 1.00 0.56 C ATOM 183 OG1 THR A 13 -14.073 -0.247 1.065 1.00 0.59 O ATOM 184 CG2 THR A 13 -16.052 -0.759 -0.217 1.00 0.74 C ATOM 185 H THR A 13 -13.256 -1.275 -0.993 1.00 0.41 H ATOM 186 HA THR A 13 -14.886 0.766 -2.012 1.00 0.52 H ATOM 187 HB THR A 13 -15.433 1.164 0.444 1.00 0.61 H ATOM 188 HG1 THR A 13 -14.531 -0.305 1.914 1.00 0.81 H ATOM 189 HG21 THR A 13 -16.745 -0.354 -0.937 1.00 1.36 H ATOM 190 HG22 THR A 13 -16.576 -0.991 0.697 1.00 1.35 H ATOM 191 HG23 THR A 13 -15.603 -1.657 -0.614 1.00 1.13 H ATOM 192 N PRO A 14 -13.975 3.057 -1.228 1.00 0.40 N ATOM 193 CA PRO A 14 -13.290 4.344 -1.044 1.00 0.38 C ATOM 194 C PRO A 14 -12.675 4.492 0.347 1.00 0.30 C ATOM 195 O PRO A 14 -11.669 5.184 0.521 1.00 0.32 O ATOM 196 CB PRO A 14 -14.401 5.372 -1.255 1.00 0.52 C ATOM 197 CG PRO A 14 -15.411 4.686 -2.102 1.00 0.68 C ATOM 198 CD PRO A 14 -15.352 3.231 -1.730 1.00 0.56 C ATOM 199 HA PRO A 14 -12.520 4.487 -1.790 1.00 0.40 H ATOM 200 HB2 PRO A 14 -14.823 5.656 -0.301 1.00 0.61 H ATOM 201 HB3 PRO A 14 -14.014 6.237 -1.766 1.00 0.65 H ATOM 202 HG2 PRO A 14 -16.394 5.090 -1.899 1.00 0.90 H ATOM 203 HG3 PRO A 14 -15.161 4.809 -3.145 1.00 0.87 H ATOM 204 HD2 PRO A 14 -16.075 3.009 -0.958 1.00 0.63 H ATOM 205 HD3 PRO A 14 -15.525 2.613 -2.598 1.00 0.63 H ATOM 206 N GLU A 15 -13.279 3.838 1.335 1.00 0.34 N ATOM 207 CA GLU A 15 -12.756 3.846 2.692 1.00 0.38 C ATOM 208 C GLU A 15 -11.404 3.140 2.751 1.00 0.32 C ATOM 209 O GLU A 15 -10.409 3.707 3.207 1.00 0.39 O ATOM 210 CB GLU A 15 -13.733 3.159 3.643 1.00 0.53 C ATOM 211 CG GLU A 15 -15.100 3.817 3.708 1.00 0.69 C ATOM 212 CD GLU A 15 -16.033 3.130 4.684 1.00 1.65 C ATOM 213 OE1 GLU A 15 -16.191 3.633 5.816 1.00 1.97 O ATOM 214 OE2 GLU A 15 -16.608 2.079 4.331 1.00 2.44 O ATOM 215 H GLU A 15 -14.096 3.328 1.144 1.00 0.40 H ATOM 216 HA GLU A 15 -12.632 4.872 2.996 1.00 0.43 H ATOM 217 HB2 GLU A 15 -13.864 2.141 3.322 1.00 0.54 H ATOM 218 HB3 GLU A 15 -13.310 3.162 4.632 1.00 0.58 H ATOM 219 HG2 GLU A 15 -14.979 4.845 4.013 1.00 0.96 H ATOM 220 HG3 GLU A 15 -15.546 3.786 2.725 1.00 1.29 H ATOM 221 N LYS A 16 -11.372 1.909 2.257 1.00 0.27 N ATOM 222 CA LYS A 16 -10.184 1.074 2.352 1.00 0.26 C ATOM 223 C LYS A 16 -9.181 1.430 1.260 1.00 0.19 C ATOM 224 O LYS A 16 -7.975 1.328 1.457 1.00 0.25 O ATOM 225 CB LYS A 16 -10.573 -0.398 2.234 1.00 0.30 C ATOM 226 CG LYS A 16 -9.482 -1.366 2.666 1.00 0.44 C ATOM 227 CD LYS A 16 -9.343 -1.403 4.178 1.00 1.16 C ATOM 228 CE LYS A 16 -8.303 -2.419 4.620 1.00 1.17 C ATOM 229 NZ LYS A 16 -8.353 -2.663 6.087 1.00 1.80 N ATOM 230 H LYS A 16 -12.169 1.553 1.808 1.00 0.30 H ATOM 231 HA LYS A 16 -9.729 1.244 3.316 1.00 0.32 H ATOM 232 HB2 LYS A 16 -11.442 -0.575 2.845 1.00 0.38 H ATOM 233 HB3 LYS A 16 -10.821 -0.608 1.204 1.00 0.26 H ATOM 234 HG2 LYS A 16 -9.730 -2.356 2.312 1.00 1.12 H ATOM 235 HG3 LYS A 16 -8.542 -1.052 2.235 1.00 1.12 H ATOM 236 HD2 LYS A 16 -9.047 -0.426 4.528 1.00 1.84 H ATOM 237 HD3 LYS A 16 -10.297 -1.668 4.611 1.00 1.91 H ATOM 238 HE2 LYS A 16 -8.482 -3.348 4.102 1.00 1.60 H ATOM 239 HE3 LYS A 16 -7.323 -2.046 4.359 1.00 1.66 H ATOM 240 HZ1 LYS A 16 -8.197 -1.776 6.605 1.00 2.19 H ATOM 241 HZ2 LYS A 16 -7.618 -3.342 6.364 1.00 2.27 H ATOM 242 HZ3 LYS A 16 -9.283 -3.047 6.353 1.00 2.33 H ATOM 243 N LEU A 17 -9.692 1.849 0.111 1.00 0.14 N ATOM 244 CA LEU A 17 -8.856 2.209 -1.022 1.00 0.13 C ATOM 245 C LEU A 17 -7.953 3.389 -0.684 1.00 0.15 C ATOM 246 O LEU A 17 -6.752 3.352 -0.944 1.00 0.19 O ATOM 247 CB LEU A 17 -9.735 2.548 -2.225 1.00 0.18 C ATOM 248 CG LEU A 17 -8.993 2.906 -3.514 1.00 0.27 C ATOM 249 CD1 LEU A 17 -8.209 1.713 -4.043 1.00 0.30 C ATOM 250 CD2 LEU A 17 -9.976 3.402 -4.556 1.00 0.36 C ATOM 251 H LEU A 17 -10.670 1.899 0.014 1.00 0.16 H ATOM 252 HA LEU A 17 -8.243 1.357 -1.262 1.00 0.18 H ATOM 253 HB2 LEU A 17 -10.370 1.698 -2.428 1.00 0.20 H ATOM 254 HB3 LEU A 17 -10.362 3.385 -1.956 1.00 0.21 H ATOM 255 HG LEU A 17 -8.291 3.702 -3.309 1.00 0.29 H ATOM 256 HD11 LEU A 17 -8.845 0.840 -4.047 1.00 1.08 H ATOM 257 HD12 LEU A 17 -7.351 1.534 -3.414 1.00 1.00 H ATOM 258 HD13 LEU A 17 -7.880 1.920 -5.048 1.00 1.02 H ATOM 259 HD21 LEU A 17 -10.483 4.279 -4.182 1.00 1.09 H ATOM 260 HD22 LEU A 17 -10.700 2.628 -4.761 1.00 1.04 H ATOM 261 HD23 LEU A 17 -9.446 3.651 -5.462 1.00 1.12 H ATOM 262 N ALA A 18 -8.530 4.429 -0.094 1.00 0.16 N ATOM 263 CA ALA A 18 -7.755 5.594 0.317 1.00 0.21 C ATOM 264 C ALA A 18 -6.770 5.210 1.414 1.00 0.20 C ATOM 265 O ALA A 18 -5.676 5.769 1.508 1.00 0.23 O ATOM 266 CB ALA A 18 -8.678 6.708 0.792 1.00 0.27 C ATOM 267 H ALA A 18 -9.498 4.414 0.066 1.00 0.17 H ATOM 268 HA ALA A 18 -7.201 5.951 -0.541 1.00 0.25 H ATOM 269 HB1 ALA A 18 -9.370 6.962 0.003 1.00 1.10 H ATOM 270 HB2 ALA A 18 -8.091 7.576 1.049 1.00 1.03 H ATOM 271 HB3 ALA A 18 -9.227 6.374 1.658 1.00 1.03 H ATOM 272 N LYS A 19 -7.163 4.237 2.226 1.00 0.19 N ATOM 273 CA LYS A 19 -6.303 3.718 3.279 1.00 0.22 C ATOM 274 C LYS A 19 -5.138 2.947 2.660 1.00 0.22 C ATOM 275 O LYS A 19 -4.000 3.031 3.122 1.00 0.27 O ATOM 276 CB LYS A 19 -7.112 2.806 4.204 1.00 0.29 C ATOM 277 CG LYS A 19 -6.398 2.446 5.492 1.00 0.43 C ATOM 278 CD LYS A 19 -7.242 1.527 6.357 1.00 1.34 C ATOM 279 CE LYS A 19 -6.650 1.373 7.748 1.00 1.73 C ATOM 280 NZ LYS A 19 -5.267 0.825 7.720 1.00 2.54 N ATOM 281 H LYS A 19 -8.059 3.855 2.112 1.00 0.19 H ATOM 282 HA LYS A 19 -5.917 4.552 3.845 1.00 0.25 H ATOM 283 HB2 LYS A 19 -8.036 3.302 4.458 1.00 0.34 H ATOM 284 HB3 LYS A 19 -7.340 1.891 3.676 1.00 0.28 H ATOM 285 HG2 LYS A 19 -5.473 1.946 5.251 1.00 0.87 H ATOM 286 HG3 LYS A 19 -6.188 3.351 6.040 1.00 1.07 H ATOM 287 HD2 LYS A 19 -8.235 1.940 6.444 1.00 1.98 H ATOM 288 HD3 LYS A 19 -7.294 0.555 5.888 1.00 1.95 H ATOM 289 HE2 LYS A 19 -6.630 2.341 8.224 1.00 2.11 H ATOM 290 HE3 LYS A 19 -7.279 0.707 8.319 1.00 2.03 H ATOM 291 HZ1 LYS A 19 -4.648 1.440 7.152 1.00 3.08 H ATOM 292 HZ2 LYS A 19 -5.266 -0.128 7.305 1.00 2.94 H ATOM 293 HZ3 LYS A 19 -4.887 0.771 8.686 1.00 2.86 H HETATM 294 N 0A1 A 20 -5.449 2.204 1.605 1.00 0.20 N HETATM 295 CA 0A1 A 20 -4.455 1.465 0.839 1.00 0.22 C HETATM 296 CB 0A1 A 20 -5.159 0.609 -0.225 1.00 0.23 C HETATM 297 CG 0A1 A 20 -4.226 -0.183 -1.114 1.00 0.26 C HETATM 298 CD1 0A1 A 20 -4.140 0.078 -2.476 1.00 0.31 C HETATM 299 CE1 0A1 A 20 -3.294 -0.645 -3.289 1.00 0.37 C HETATM 300 CZ 0A1 A 20 -2.512 -1.653 -2.746 1.00 0.39 C HETATM 301 OH 0A1 A 20 -1.647 -2.400 -3.538 1.00 0.48 O HETATM 302 CM 0A1 A 20 -1.848 -2.125 -4.932 1.00 0.78 C HETATM 303 CE2 0A1 A 20 -2.584 -1.925 -1.398 1.00 0.38 C HETATM 304 CD2 0A1 A 20 -3.436 -1.194 -0.593 1.00 0.32 C HETATM 305 C 0A1 A 20 -3.468 2.428 0.186 1.00 0.23 C HETATM 306 O 0A1 A 20 -2.260 2.213 0.222 1.00 0.26 O HETATM 307 HN1 0A1 A 20 -6.392 2.140 1.335 1.00 0.19 H HETATM 308 HA 0A1 A 20 -3.920 0.819 1.517 1.00 0.26 H HETATM 309 HBC1 0A1 A 20 -5.749 1.257 -0.858 1.00 0.23 H HETATM 310 HBC2 0A1 A 20 -5.814 -0.091 0.269 1.00 0.26 H HETATM 311 HD1 0A1 A 20 -4.749 0.860 -2.900 1.00 0.34 H HETATM 312 HD2 0A1 A 20 -3.493 -1.411 0.462 1.00 0.36 H HETATM 313 HE1 0A1 A 20 -3.247 -0.423 -4.343 1.00 0.44 H HETATM 314 HE2 0A1 A 20 -1.978 -2.709 -0.969 1.00 0.45 H HETATM 315 HMC1 0A1 A 20 -1.711 -1.070 -5.119 1.00 1.34 H HETATM 316 HMC2 0A1 A 20 -2.846 -2.418 -5.217 1.00 1.25 H HETATM 317 HMC3 0A1 A 20 -1.134 -2.695 -5.512 1.00 1.48 H ATOM 318 N GLN A 21 -3.996 3.500 -0.391 1.00 0.21 N ATOM 319 CA GLN A 21 -3.168 4.525 -1.015 1.00 0.26 C ATOM 320 C GLN A 21 -2.261 5.189 0.011 1.00 0.29 C ATOM 321 O GLN A 21 -1.068 5.384 -0.225 1.00 0.34 O ATOM 322 CB GLN A 21 -4.050 5.575 -1.688 1.00 0.27 C ATOM 323 CG GLN A 21 -4.876 5.024 -2.835 1.00 0.30 C ATOM 324 CD GLN A 21 -4.026 4.365 -3.904 1.00 1.32 C ATOM 325 OE1 GLN A 21 -2.878 4.747 -4.127 1.00 1.99 O ATOM 326 NE2 GLN A 21 -4.586 3.371 -4.575 1.00 1.78 N ATOM 327 H GLN A 21 -4.973 3.602 -0.403 1.00 0.19 H ATOM 328 HA GLN A 21 -2.555 4.047 -1.764 1.00 0.28 H ATOM 329 HB2 GLN A 21 -4.726 5.983 -0.952 1.00 0.25 H ATOM 330 HB3 GLN A 21 -3.426 6.367 -2.068 1.00 0.33 H ATOM 331 HG2 GLN A 21 -5.566 4.292 -2.442 1.00 0.95 H ATOM 332 HG3 GLN A 21 -5.431 5.835 -3.284 1.00 0.92 H ATOM 333 HE21 GLN A 21 -5.504 3.119 -4.350 1.00 1.48 H ATOM 334 HE22 GLN A 21 -4.054 2.928 -5.272 1.00 2.56 H ATOM 335 N ALA A 22 -2.833 5.516 1.162 1.00 0.27 N ATOM 336 CA ALA A 22 -2.078 6.133 2.245 1.00 0.33 C ATOM 337 C ALA A 22 -1.016 5.177 2.782 1.00 0.31 C ATOM 338 O ALA A 22 -0.001 5.600 3.338 1.00 0.34 O ATOM 339 CB ALA A 22 -3.015 6.564 3.362 1.00 0.38 C ATOM 340 H ALA A 22 -3.794 5.343 1.282 1.00 0.24 H ATOM 341 HA ALA A 22 -1.592 7.013 1.851 1.00 0.36 H ATOM 342 HB1 ALA A 22 -3.751 7.248 2.971 1.00 1.04 H ATOM 343 HB2 ALA A 22 -2.446 7.052 4.141 1.00 1.08 H ATOM 344 HB3 ALA A 22 -3.510 5.695 3.770 1.00 1.13 H ATOM 345 N ASP A 23 -1.261 3.885 2.615 1.00 0.28 N ATOM 346 CA ASP A 23 -0.317 2.867 3.047 1.00 0.28 C ATOM 347 C ASP A 23 0.780 2.720 2.005 1.00 0.24 C ATOM 348 O ASP A 23 1.950 2.536 2.338 1.00 0.24 O ATOM 349 CB ASP A 23 -1.027 1.530 3.252 1.00 0.30 C ATOM 350 CG ASP A 23 -0.316 0.640 4.251 1.00 0.36 C ATOM 351 OD1 ASP A 23 -0.770 0.529 5.407 1.00 0.57 O ATOM 352 OD2 ASP A 23 0.717 0.047 3.872 1.00 0.55 O ATOM 353 H ASP A 23 -2.104 3.608 2.196 1.00 0.28 H ATOM 354 HA ASP A 23 0.123 3.187 3.980 1.00 0.31 H ATOM 355 HB2 ASP A 23 -2.028 1.716 3.611 1.00 0.33 H ATOM 356 HB3 ASP A 23 -1.080 1.011 2.306 1.00 0.31 H ATOM 357 N LEU A 24 0.393 2.831 0.738 1.00 0.24 N ATOM 358 CA LEU A 24 1.340 2.779 -0.369 1.00 0.22 C ATOM 359 C LEU A 24 2.337 3.920 -0.279 1.00 0.23 C ATOM 360 O LEU A 24 3.485 3.778 -0.686 1.00 0.22 O ATOM 361 CB LEU A 24 0.615 2.846 -1.712 1.00 0.26 C ATOM 362 CG LEU A 24 -0.233 1.627 -2.064 1.00 0.29 C ATOM 363 CD1 LEU A 24 -0.868 1.812 -3.429 1.00 0.32 C ATOM 364 CD2 LEU A 24 0.609 0.359 -2.033 1.00 0.27 C ATOM 365 H LEU A 24 -0.563 2.944 0.540 1.00 0.27 H ATOM 366 HA LEU A 24 1.872 1.844 -0.307 1.00 0.22 H ATOM 367 HB2 LEU A 24 -0.028 3.714 -1.704 1.00 0.30 H ATOM 368 HB3 LEU A 24 1.354 2.976 -2.489 1.00 0.24 H ATOM 369 HG LEU A 24 -1.026 1.523 -1.336 1.00 0.32 H ATOM 370 HD11 LEU A 24 -0.093 1.934 -4.171 1.00 1.15 H ATOM 371 HD12 LEU A 24 -1.497 2.689 -3.416 1.00 1.08 H ATOM 372 HD13 LEU A 24 -1.463 0.944 -3.670 1.00 0.97 H ATOM 373 HD21 LEU A 24 1.440 0.461 -2.716 1.00 0.96 H ATOM 374 HD22 LEU A 24 0.001 -0.483 -2.331 1.00 0.98 H ATOM 375 HD23 LEU A 24 0.982 0.197 -1.033 1.00 1.03 H ATOM 376 N ALA A 25 1.894 5.043 0.268 1.00 0.26 N ATOM 377 CA ALA A 25 2.763 6.197 0.451 1.00 0.30 C ATOM 378 C ALA A 25 3.934 5.849 1.358 1.00 0.28 C ATOM 379 O ALA A 25 5.033 6.387 1.219 1.00 0.33 O ATOM 380 CB ALA A 25 1.972 7.363 1.024 1.00 0.37 C ATOM 381 H ALA A 25 0.953 5.104 0.539 1.00 0.28 H ATOM 382 HA ALA A 25 3.140 6.484 -0.514 1.00 0.34 H ATOM 383 HB1 ALA A 25 1.153 7.603 0.362 1.00 1.08 H ATOM 384 HB2 ALA A 25 2.618 8.221 1.124 1.00 1.05 H ATOM 385 HB3 ALA A 25 1.582 7.091 1.994 1.00 1.09 H ATOM 386 N LYS A 26 3.688 4.934 2.276 1.00 0.26 N ATOM 387 CA LYS A 26 4.709 4.476 3.199 1.00 0.28 C ATOM 388 C LYS A 26 5.446 3.276 2.611 1.00 0.22 C ATOM 389 O LYS A 26 6.678 3.211 2.640 1.00 0.22 O ATOM 390 CB LYS A 26 4.068 4.095 4.533 1.00 0.38 C ATOM 391 CG LYS A 26 3.173 5.180 5.115 1.00 0.49 C ATOM 392 CD LYS A 26 2.610 4.769 6.465 1.00 1.26 C ATOM 393 CE LYS A 26 1.613 5.788 6.998 1.00 1.78 C ATOM 394 NZ LYS A 26 0.369 5.838 6.182 1.00 2.48 N ATOM 395 H LYS A 26 2.792 4.549 2.329 1.00 0.26 H ATOM 396 HA LYS A 26 5.410 5.282 3.356 1.00 0.33 H ATOM 397 HB2 LYS A 26 3.473 3.205 4.393 1.00 0.39 H ATOM 398 HB3 LYS A 26 4.849 3.885 5.244 1.00 0.43 H ATOM 399 HG2 LYS A 26 3.752 6.083 5.238 1.00 0.94 H ATOM 400 HG3 LYS A 26 2.356 5.363 4.432 1.00 0.89 H ATOM 401 HD2 LYS A 26 2.111 3.818 6.359 1.00 1.84 H ATOM 402 HD3 LYS A 26 3.424 4.674 7.168 1.00 1.81 H ATOM 403 HE2 LYS A 26 1.354 5.522 8.011 1.00 2.10 H ATOM 404 HE3 LYS A 26 2.078 6.763 6.991 1.00 2.31 H ATOM 405 HZ1 LYS A 26 -0.295 6.528 6.588 1.00 2.99 H ATOM 406 HZ2 LYS A 26 -0.087 4.905 6.168 1.00 2.94 H ATOM 407 HZ3 LYS A 26 0.590 6.121 5.203 1.00 2.73 H HETATM 408 N 0A1 A 27 4.676 2.332 2.076 1.00 0.21 N HETATM 409 CA 0A1 A 27 5.223 1.106 1.508 1.00 0.19 C HETATM 410 CB 0A1 A 27 4.099 0.140 1.123 1.00 0.23 C HETATM 411 CG 0A1 A 27 4.588 -1.100 0.407 1.00 0.22 C HETATM 412 CD1 0A1 A 27 4.226 -1.351 -0.909 1.00 1.04 C HETATM 413 CE1 0A1 A 27 4.671 -2.476 -1.566 1.00 1.12 C HETATM 414 CZ 0A1 A 27 5.497 -3.374 -0.912 1.00 0.33 C HETATM 415 OH 0A1 A 27 5.948 -4.509 -1.560 1.00 0.42 O HETATM 416 CM 0A1 A 27 4.966 -4.952 -2.507 1.00 0.78 C HETATM 417 CE2 0A1 A 27 5.875 -3.143 0.391 1.00 1.02 C HETATM 418 CD2 0A1 A 27 5.421 -2.012 1.043 1.00 1.06 C HETATM 419 C 0A1 A 27 6.098 1.379 0.291 1.00 0.15 C HETATM 420 O 0A1 A 27 7.271 1.029 0.286 1.00 0.19 O HETATM 421 HN1 0A1 A 27 3.700 2.463 2.072 1.00 0.23 H HETATM 422 HA 0A1 A 27 5.831 0.640 2.267 1.00 0.24 H HETATM 423 HBC1 0A1 A 27 3.404 0.649 0.471 1.00 0.24 H HETATM 424 HBC2 0A1 A 27 3.582 -0.176 2.016 1.00 0.30 H HETATM 425 HD1 0A1 A 27 3.580 -0.655 -1.419 1.00 1.81 H HETATM 426 HD2 0A1 A 27 5.711 -1.828 2.067 1.00 1.88 H HETATM 427 HE1 0A1 A 27 4.381 -2.650 -2.591 1.00 1.94 H HETATM 428 HE2 0A1 A 27 6.521 -3.843 0.905 1.00 1.79 H HETATM 429 HMC1 0A1 A 27 4.904 -6.029 -2.493 1.00 1.41 H HETATM 430 HMC2 0A1 A 27 5.240 -4.614 -3.493 1.00 1.11 H HETATM 431 HMC3 0A1 A 27 4.005 -4.529 -2.243 1.00 1.38 H ATOM 432 N GLN A 28 5.527 2.019 -0.728 1.00 0.15 N ATOM 433 CA GLN A 28 6.210 2.196 -2.010 1.00 0.22 C ATOM 434 C GLN A 28 7.495 2.996 -1.853 1.00 0.27 C ATOM 435 O GLN A 28 8.450 2.794 -2.599 1.00 0.36 O ATOM 436 CB GLN A 28 5.291 2.883 -3.022 1.00 0.27 C ATOM 437 CG GLN A 28 4.098 2.037 -3.433 1.00 0.37 C ATOM 438 CD GLN A 28 3.130 2.795 -4.320 1.00 0.45 C ATOM 439 OE1 GLN A 28 2.995 4.014 -4.211 1.00 0.72 O ATOM 440 NE2 GLN A 28 2.452 2.083 -5.204 1.00 0.38 N ATOM 441 H GLN A 28 4.625 2.397 -0.612 1.00 0.16 H ATOM 442 HA GLN A 28 6.460 1.216 -2.382 1.00 0.27 H ATOM 443 HB2 GLN A 28 4.922 3.801 -2.589 1.00 0.26 H ATOM 444 HB3 GLN A 28 5.863 3.117 -3.908 1.00 0.35 H ATOM 445 HG2 GLN A 28 4.453 1.172 -3.972 1.00 0.44 H ATOM 446 HG3 GLN A 28 3.575 1.718 -2.543 1.00 0.38 H ATOM 447 HE21 GLN A 28 2.609 1.116 -5.240 1.00 0.46 H ATOM 448 HE22 GLN A 28 1.814 2.550 -5.787 1.00 0.43 H ATOM 449 N LYS A 29 7.521 3.890 -0.876 1.00 0.26 N ATOM 450 CA LYS A 29 8.700 4.681 -0.600 1.00 0.36 C ATOM 451 C LYS A 29 9.860 3.771 -0.200 1.00 0.43 C ATOM 452 O LYS A 29 10.944 3.827 -0.783 1.00 0.55 O ATOM 453 CB LYS A 29 8.396 5.679 0.514 1.00 0.38 C ATOM 454 CG LYS A 29 9.449 6.753 0.665 1.00 0.53 C ATOM 455 CD LYS A 29 9.113 7.709 1.798 1.00 0.84 C ATOM 456 CE LYS A 29 10.102 8.864 1.868 1.00 1.50 C ATOM 457 NZ LYS A 29 10.094 9.680 0.625 1.00 2.36 N ATOM 458 H LYS A 29 6.723 4.029 -0.332 1.00 0.23 H ATOM 459 HA LYS A 29 8.965 5.217 -1.498 1.00 0.42 H ATOM 460 HB2 LYS A 29 7.451 6.160 0.303 1.00 0.38 H ATOM 461 HB3 LYS A 29 8.317 5.146 1.449 1.00 0.40 H ATOM 462 HG2 LYS A 29 10.397 6.283 0.870 1.00 0.70 H ATOM 463 HG3 LYS A 29 9.510 7.307 -0.258 1.00 0.74 H ATOM 464 HD2 LYS A 29 8.123 8.106 1.637 1.00 1.31 H ATOM 465 HD3 LYS A 29 9.139 7.167 2.731 1.00 1.23 H ATOM 466 HE2 LYS A 29 9.839 9.495 2.703 1.00 1.91 H ATOM 467 HE3 LYS A 29 11.092 8.464 2.019 1.00 2.00 H ATOM 468 HZ1 LYS A 29 10.403 9.105 -0.184 1.00 2.75 H ATOM 469 HZ2 LYS A 29 10.735 10.490 0.723 1.00 2.67 H ATOM 470 HZ3 LYS A 29 9.134 10.037 0.437 1.00 2.94 H ATOM 471 N ASP A 30 9.615 2.926 0.795 1.00 0.41 N ATOM 472 CA ASP A 30 10.613 1.967 1.257 1.00 0.52 C ATOM 473 C ASP A 30 10.828 0.873 0.215 1.00 0.49 C ATOM 474 O ASP A 30 11.928 0.355 0.051 1.00 0.61 O ATOM 475 CB ASP A 30 10.176 1.343 2.583 1.00 0.57 C ATOM 476 CG ASP A 30 11.326 0.692 3.321 1.00 0.71 C ATOM 477 OD1 ASP A 30 11.574 -0.512 3.118 1.00 0.75 O ATOM 478 OD2 ASP A 30 11.990 1.392 4.116 1.00 0.94 O ATOM 479 H ASP A 30 8.737 2.945 1.229 1.00 0.37 H ATOM 480 HA ASP A 30 11.543 2.497 1.405 1.00 0.63 H ATOM 481 HB2 ASP A 30 9.757 2.110 3.214 1.00 0.65 H ATOM 482 HB3 ASP A 30 9.425 0.592 2.389 1.00 0.48 H ATOM 483 N LEU A 31 9.756 0.530 -0.487 1.00 0.37 N ATOM 484 CA LEU A 31 9.780 -0.510 -1.505 1.00 0.41 C ATOM 485 C LEU A 31 10.694 -0.107 -2.662 1.00 0.58 C ATOM 486 O LEU A 31 11.399 -0.941 -3.226 1.00 0.65 O ATOM 487 CB LEU A 31 8.337 -0.772 -1.982 1.00 0.39 C ATOM 488 CG LEU A 31 8.075 -1.989 -2.885 1.00 0.55 C ATOM 489 CD1 LEU A 31 8.371 -1.658 -4.331 1.00 1.16 C ATOM 490 CD2 LEU A 31 8.872 -3.206 -2.440 1.00 1.33 C ATOM 491 H LEU A 31 8.905 0.986 -0.302 1.00 0.30 H ATOM 492 HA LEU A 31 10.173 -1.400 -1.044 1.00 0.41 H ATOM 493 HB2 LEU A 31 7.716 -0.878 -1.111 1.00 0.33 H ATOM 494 HB3 LEU A 31 8.010 0.107 -2.517 1.00 0.44 H ATOM 495 HG LEU A 31 7.027 -2.244 -2.821 1.00 1.45 H ATOM 496 HD11 LEU A 31 9.398 -1.341 -4.424 1.00 1.78 H ATOM 497 HD12 LEU A 31 7.716 -0.864 -4.654 1.00 1.78 H ATOM 498 HD13 LEU A 31 8.204 -2.533 -4.942 1.00 1.70 H ATOM 499 HD21 LEU A 31 9.923 -3.039 -2.617 1.00 1.86 H ATOM 500 HD22 LEU A 31 8.547 -4.070 -3.000 1.00 1.86 H ATOM 501 HD23 LEU A 31 8.703 -3.380 -1.386 1.00 2.00 H ATOM 502 N ALA A 32 10.678 1.177 -3.006 1.00 0.66 N ATOM 503 CA ALA A 32 11.571 1.708 -4.029 1.00 0.86 C ATOM 504 C ALA A 32 13.025 1.632 -3.569 1.00 0.94 C ATOM 505 O ALA A 32 13.945 1.523 -4.384 1.00 1.08 O ATOM 506 CB ALA A 32 11.193 3.141 -4.367 1.00 0.96 C ATOM 507 H ALA A 32 10.041 1.783 -2.567 1.00 0.61 H ATOM 508 HA ALA A 32 11.453 1.107 -4.919 1.00 0.91 H ATOM 509 HB1 ALA A 32 11.338 3.766 -3.499 1.00 1.56 H ATOM 510 HB2 ALA A 32 10.156 3.179 -4.669 1.00 1.38 H ATOM 511 HB3 ALA A 32 11.816 3.496 -5.175 1.00 1.28 H ATOM 512 N ASP A 33 13.221 1.704 -2.257 1.00 0.91 N ATOM 513 CA ASP A 33 14.543 1.550 -1.662 1.00 1.06 C ATOM 514 C ASP A 33 14.950 0.084 -1.698 1.00 1.02 C ATOM 515 O ASP A 33 16.115 -0.251 -1.904 1.00 1.18 O ATOM 516 CB ASP A 33 14.538 2.064 -0.218 1.00 1.12 C ATOM 517 CG ASP A 33 15.866 1.870 0.487 1.00 1.31 C ATOM 518 OD1 ASP A 33 16.712 2.789 0.430 1.00 1.46 O ATOM 519 OD2 ASP A 33 16.063 0.814 1.118 1.00 1.38 O ATOM 520 H ASP A 33 12.451 1.858 -1.671 1.00 0.83 H ATOM 521 HA ASP A 33 15.245 2.127 -2.245 1.00 1.20 H ATOM 522 HB2 ASP A 33 14.309 3.118 -0.223 1.00 1.16 H ATOM 523 HB3 ASP A 33 13.776 1.539 0.338 1.00 1.04 H HETATM 524 N 0A1 A 34 13.966 -0.782 -1.507 1.00 0.84 N HETATM 525 CA 0A1 A 34 14.161 -2.220 -1.580 1.00 0.82 C HETATM 526 CB 0A1 A 34 12.979 -2.931 -0.912 1.00 0.66 C HETATM 527 CG 0A1 A 34 13.061 -4.441 -0.949 1.00 0.70 C HETATM 528 CD1 0A1 A 34 14.052 -5.123 -0.258 1.00 1.27 C HETATM 529 CE1 0A1 A 34 14.126 -6.501 -0.297 1.00 1.35 C HETATM 530 CZ 0A1 A 34 13.197 -7.220 -1.034 1.00 0.94 C HETATM 531 OH 0A1 A 34 13.242 -8.609 -1.093 1.00 1.11 O HETATM 532 CM 0A1 A 34 14.532 -9.110 -0.708 1.00 1.53 C HETATM 533 CE2 0A1 A 34 12.204 -6.557 -1.722 1.00 1.52 C HETATM 534 CD2 0A1 A 34 12.141 -5.179 -1.677 1.00 1.45 C HETATM 535 C 0A1 A 34 14.315 -2.665 -3.036 1.00 0.88 C HETATM 536 O 0A1 A 34 13.349 -3.065 -3.684 1.00 1.46 O HETATM 537 HN1 0A1 A 34 13.069 -0.436 -1.306 1.00 0.74 H HETATM 538 HA 0A1 A 34 15.062 -2.466 -1.044 1.00 0.94 H HETATM 539 HBC1 0A1 A 34 12.073 -2.638 -1.414 1.00 0.60 H HETATM 540 HBC2 0A1 A 34 12.923 -2.627 0.121 1.00 0.69 H HETATM 541 HD1 0A1 A 34 14.777 -4.564 0.314 1.00 2.06 H HETATM 542 HD2 0A1 A 34 11.363 -4.660 -2.218 1.00 2.25 H HETATM 543 HE1 0A1 A 34 14.904 -7.008 0.250 1.00 2.14 H HETATM 544 HE2 0A1 A 34 11.477 -7.109 -2.298 1.00 2.34 H HETATM 545 HMC1 0A1 A 34 14.735 -10.032 -1.233 1.00 1.87 H HETATM 546 HMC2 0A1 A 34 14.554 -9.282 0.356 1.00 2.13 H HETATM 547 HMC3 0A1 A 34 15.286 -8.378 -0.964 1.00 2.08 H HETATM 548 N NH2 A 35 15.529 -2.572 -3.555 1.00 1.14 N HETATM 549 HN1 NH2 A 35 15.792 -2.221 -2.677 1.00 1.36 H HETATM 550 HN2 NH2 A 35 16.151 -2.687 -4.302 1.00 1.45 H TER 551 NH2 A 35