HETATM 1 C ACE A 0 12.744 -6.526 3.140 1.00 0.95 C HETATM 2 O ACE A 0 13.145 -5.442 3.566 1.00 0.95 O HETATM 3 CH3 ACE A 0 13.362 -7.813 3.612 1.00 1.17 C HETATM 4 H1 ACE A 0 12.841 -8.142 4.505 1.00 1.49 H HETATM 5 H2 ACE A 0 14.396 -7.650 3.840 1.00 1.66 H HETATM 6 H3 ACE A 0 13.277 -8.549 2.818 1.00 1.58 H ATOM 7 N PRO A 1 11.754 -6.614 2.238 1.00 0.84 N ATOM 8 CA PRO A 1 10.974 -5.452 1.807 1.00 0.69 C ATOM 9 C PRO A 1 10.158 -4.851 2.946 1.00 0.57 C ATOM 10 O PRO A 1 9.985 -5.474 3.997 1.00 0.60 O ATOM 11 CB PRO A 1 10.040 -6.013 0.729 1.00 0.75 C ATOM 12 CG PRO A 1 10.007 -7.484 0.948 1.00 0.91 C ATOM 13 CD PRO A 1 11.328 -7.851 1.560 1.00 0.97 C ATOM 14 HA PRO A 1 11.608 -4.691 1.377 1.00 0.71 H ATOM 15 HB2 PRO A 1 9.053 -5.585 0.845 1.00 0.87 H ATOM 16 HB3 PRO A 1 10.430 -5.791 -0.247 1.00 0.76 H ATOM 17 HG2 PRO A 1 9.195 -7.736 1.619 1.00 1.14 H ATOM 18 HG3 PRO A 1 9.886 -7.994 0.005 1.00 1.06 H ATOM 19 HD2 PRO A 1 11.204 -8.655 2.270 1.00 1.03 H ATOM 20 HD3 PRO A 1 12.034 -8.131 0.793 1.00 1.19 H ATOM 21 N PRO A 2 9.660 -3.625 2.757 1.00 0.51 N ATOM 22 CA PRO A 2 8.761 -2.986 3.717 1.00 0.47 C ATOM 23 C PRO A 2 7.415 -3.698 3.791 1.00 0.42 C ATOM 24 O PRO A 2 7.175 -4.683 3.087 1.00 0.43 O ATOM 25 CB PRO A 2 8.590 -1.568 3.170 1.00 0.50 C ATOM 26 CG PRO A 2 8.949 -1.650 1.728 1.00 0.55 C ATOM 27 CD PRO A 2 9.945 -2.762 1.598 1.00 0.56 C ATOM 28 HA PRO A 2 9.195 -2.945 4.706 1.00 0.52 H ATOM 29 HB2 PRO A 2 7.564 -1.248 3.297 1.00 0.66 H ATOM 30 HB3 PRO A 2 9.258 -0.893 3.680 1.00 0.61 H ATOM 31 HG2 PRO A 2 8.067 -1.865 1.143 1.00 0.72 H ATOM 32 HG3 PRO A 2 9.394 -0.721 1.407 1.00 0.86 H ATOM 33 HD2 PRO A 2 9.789 -3.300 0.674 1.00 0.62 H ATOM 34 HD3 PRO A 2 10.953 -2.378 1.643 1.00 0.79 H ATOM 35 N THR A 3 6.544 -3.206 4.649 1.00 0.45 N ATOM 36 CA THR A 3 5.228 -3.790 4.814 1.00 0.45 C ATOM 37 C THR A 3 4.321 -3.452 3.638 1.00 0.38 C ATOM 38 O THR A 3 3.976 -2.291 3.419 1.00 0.44 O ATOM 39 CB THR A 3 4.585 -3.314 6.124 1.00 0.57 C ATOM 40 OG1 THR A 3 4.920 -1.939 6.362 1.00 0.63 O ATOM 41 CG2 THR A 3 5.049 -4.170 7.289 1.00 0.70 C ATOM 42 H THR A 3 6.788 -2.426 5.186 1.00 0.51 H ATOM 43 HA THR A 3 5.345 -4.864 4.866 1.00 0.50 H ATOM 44 HB THR A 3 3.513 -3.404 6.034 1.00 0.57 H ATOM 45 HG1 THR A 3 4.136 -1.472 6.681 1.00 1.14 H ATOM 46 HG21 THR A 3 6.118 -4.071 7.404 1.00 1.25 H ATOM 47 HG22 THR A 3 4.802 -5.205 7.097 1.00 1.31 H ATOM 48 HG23 THR A 3 4.557 -3.845 8.193 1.00 1.20 H ATOM 49 N LYS A 4 3.961 -4.468 2.872 1.00 0.36 N ATOM 50 CA LYS A 4 3.077 -4.284 1.736 1.00 0.32 C ATOM 51 C LYS A 4 1.628 -4.496 2.157 1.00 0.30 C ATOM 52 O LYS A 4 1.331 -5.404 2.937 1.00 0.37 O ATOM 53 CB LYS A 4 3.470 -5.226 0.599 1.00 0.40 C ATOM 54 CG LYS A 4 3.599 -6.683 1.005 1.00 0.54 C ATOM 55 CD LYS A 4 4.481 -7.434 0.026 1.00 0.91 C ATOM 56 CE LYS A 4 3.879 -7.465 -1.372 1.00 1.42 C ATOM 57 NZ LYS A 4 4.783 -8.124 -2.353 1.00 1.96 N ATOM 58 H LYS A 4 4.291 -5.365 3.081 1.00 0.46 H ATOM 59 HA LYS A 4 3.194 -3.268 1.397 1.00 0.33 H ATOM 60 HB2 LYS A 4 2.726 -5.159 -0.179 1.00 0.43 H ATOM 61 HB3 LYS A 4 4.421 -4.904 0.198 1.00 0.44 H ATOM 62 HG2 LYS A 4 4.039 -6.737 1.991 1.00 1.02 H ATOM 63 HG3 LYS A 4 2.618 -7.134 1.017 1.00 0.90 H ATOM 64 HD2 LYS A 4 5.438 -6.934 -0.021 1.00 1.39 H ATOM 65 HD3 LYS A 4 4.616 -8.448 0.378 1.00 1.43 H ATOM 66 HE2 LYS A 4 2.947 -8.007 -1.338 1.00 1.78 H ATOM 67 HE3 LYS A 4 3.694 -6.451 -1.692 1.00 2.07 H ATOM 68 HZ1 LYS A 4 4.354 -8.107 -3.302 1.00 2.37 H ATOM 69 HZ2 LYS A 4 4.948 -9.112 -2.083 1.00 2.18 H ATOM 70 HZ3 LYS A 4 5.698 -7.630 -2.391 1.00 2.55 H ATOM 71 N PRO A 5 0.713 -3.651 1.672 1.00 0.29 N ATOM 72 CA PRO A 5 -0.686 -3.700 2.073 1.00 0.33 C ATOM 73 C PRO A 5 -1.497 -4.725 1.284 1.00 0.33 C ATOM 74 O PRO A 5 -1.026 -5.279 0.285 1.00 0.42 O ATOM 75 CB PRO A 5 -1.177 -2.283 1.786 1.00 0.38 C ATOM 76 CG PRO A 5 -0.291 -1.748 0.708 1.00 0.44 C ATOM 77 CD PRO A 5 0.968 -2.580 0.692 1.00 0.36 C ATOM 78 HA PRO A 5 -0.783 -3.906 3.127 1.00 0.40 H ATOM 79 HB2 PRO A 5 -2.208 -2.315 1.458 1.00 0.47 H ATOM 80 HB3 PRO A 5 -1.088 -1.675 2.671 1.00 0.48 H ATOM 81 HG2 PRO A 5 -0.797 -1.821 -0.244 1.00 0.66 H ATOM 82 HG3 PRO A 5 -0.044 -0.720 0.920 1.00 0.69 H ATOM 83 HD2 PRO A 5 1.128 -2.996 -0.291 1.00 0.48 H ATOM 84 HD3 PRO A 5 1.816 -1.981 0.988 1.00 0.54 H ATOM 85 N THR A 6 -2.714 -4.975 1.744 1.00 0.41 N ATOM 86 CA THR A 6 -3.595 -5.934 1.098 1.00 0.48 C ATOM 87 C THR A 6 -4.235 -5.324 -0.144 1.00 0.36 C ATOM 88 O THR A 6 -4.466 -4.116 -0.210 1.00 0.34 O ATOM 89 CB THR A 6 -4.693 -6.436 2.067 1.00 0.68 C ATOM 90 OG1 THR A 6 -5.478 -7.466 1.451 1.00 0.79 O ATOM 91 CG2 THR A 6 -5.608 -5.298 2.504 1.00 0.74 C ATOM 92 H THR A 6 -3.031 -4.499 2.541 1.00 0.52 H ATOM 93 HA THR A 6 -2.996 -6.780 0.800 1.00 0.53 H ATOM 94 HB THR A 6 -4.213 -6.843 2.943 1.00 0.75 H ATOM 95 HG1 THR A 6 -5.870 -8.018 2.142 1.00 1.10 H ATOM 96 HG21 THR A 6 -6.365 -5.682 3.172 1.00 1.30 H ATOM 97 HG22 THR A 6 -6.081 -4.863 1.636 1.00 1.25 H ATOM 98 HG23 THR A 6 -5.027 -4.544 3.014 1.00 1.26 H ATOM 99 N LYS A 7 -4.501 -6.161 -1.134 1.00 0.36 N ATOM 100 CA LYS A 7 -5.099 -5.706 -2.377 1.00 0.30 C ATOM 101 C LYS A 7 -6.603 -5.528 -2.219 1.00 0.28 C ATOM 102 O LYS A 7 -7.296 -6.424 -1.729 1.00 0.37 O ATOM 103 CB LYS A 7 -4.807 -6.701 -3.502 1.00 0.38 C ATOM 104 CG LYS A 7 -3.323 -6.944 -3.725 1.00 0.52 C ATOM 105 CD LYS A 7 -2.587 -5.645 -4.003 1.00 0.64 C ATOM 106 CE LYS A 7 -1.118 -5.885 -4.311 1.00 0.88 C ATOM 107 NZ LYS A 7 -0.927 -6.782 -5.480 1.00 1.68 N ATOM 108 H LYS A 7 -4.288 -7.110 -1.026 1.00 0.46 H ATOM 109 HA LYS A 7 -4.661 -4.754 -2.628 1.00 0.29 H ATOM 110 HB2 LYS A 7 -5.273 -7.645 -3.260 1.00 0.48 H ATOM 111 HB3 LYS A 7 -5.232 -6.325 -4.420 1.00 0.45 H ATOM 112 HG2 LYS A 7 -2.906 -7.399 -2.840 1.00 0.91 H ATOM 113 HG3 LYS A 7 -3.199 -7.606 -4.569 1.00 0.95 H ATOM 114 HD2 LYS A 7 -3.048 -5.158 -4.847 1.00 1.00 H ATOM 115 HD3 LYS A 7 -2.663 -5.008 -3.134 1.00 0.91 H ATOM 116 HE2 LYS A 7 -0.651 -4.936 -4.520 1.00 1.40 H ATOM 117 HE3 LYS A 7 -0.651 -6.330 -3.446 1.00 1.32 H ATOM 118 HZ1 LYS A 7 0.082 -6.832 -5.731 1.00 2.13 H ATOM 119 HZ2 LYS A 7 -1.460 -6.427 -6.299 1.00 2.29 H ATOM 120 HZ3 LYS A 7 -1.260 -7.740 -5.253 1.00 2.09 H ATOM 121 N PRO A 8 -7.124 -4.362 -2.617 1.00 0.30 N ATOM 122 CA PRO A 8 -8.555 -4.085 -2.571 1.00 0.36 C ATOM 123 C PRO A 8 -9.306 -4.682 -3.764 1.00 0.28 C ATOM 124 O PRO A 8 -9.269 -4.144 -4.873 1.00 0.35 O ATOM 125 CB PRO A 8 -8.605 -2.559 -2.602 1.00 0.55 C ATOM 126 CG PRO A 8 -7.392 -2.147 -3.362 1.00 0.73 C ATOM 127 CD PRO A 8 -6.351 -3.208 -3.117 1.00 0.37 C ATOM 128 HA PRO A 8 -8.996 -4.443 -1.656 1.00 0.46 H ATOM 129 HB2 PRO A 8 -9.506 -2.232 -3.103 1.00 0.59 H ATOM 130 HB3 PRO A 8 -8.566 -2.165 -1.600 1.00 0.77 H ATOM 131 HG2 PRO A 8 -7.629 -2.089 -4.414 1.00 1.03 H ATOM 132 HG3 PRO A 8 -7.039 -1.194 -3.001 1.00 1.08 H ATOM 133 HD2 PRO A 8 -5.843 -3.454 -4.039 1.00 0.50 H ATOM 134 HD3 PRO A 8 -5.640 -2.871 -2.377 1.00 0.36 H ATOM 135 N GLY A 9 -9.971 -5.804 -3.534 1.00 0.31 N ATOM 136 CA GLY A 9 -10.745 -6.436 -4.585 1.00 0.37 C ATOM 137 C GLY A 9 -12.220 -6.134 -4.466 1.00 0.47 C ATOM 138 O GLY A 9 -12.783 -5.385 -5.267 1.00 0.51 O ATOM 139 H GLY A 9 -9.936 -6.210 -2.643 1.00 0.41 H ATOM 140 HA2 GLY A 9 -10.395 -6.086 -5.537 1.00 0.39 H ATOM 141 HA3 GLY A 9 -10.602 -7.505 -4.529 1.00 0.47 H ATOM 142 N ASP A 10 -12.842 -6.711 -3.456 1.00 0.62 N ATOM 143 CA ASP A 10 -14.254 -6.468 -3.185 1.00 0.82 C ATOM 144 C ASP A 10 -14.411 -5.427 -2.090 1.00 0.85 C ATOM 145 O ASP A 10 -15.391 -4.685 -2.045 1.00 1.09 O ATOM 146 CB ASP A 10 -14.961 -7.764 -2.787 1.00 1.05 C ATOM 147 CG ASP A 10 -16.413 -7.542 -2.412 1.00 1.81 C ATOM 148 OD1 ASP A 10 -16.750 -7.688 -1.221 1.00 2.41 O ATOM 149 OD2 ASP A 10 -17.219 -7.216 -3.306 1.00 2.32 O ATOM 150 H ASP A 10 -12.337 -7.328 -2.883 1.00 0.65 H ATOM 151 HA ASP A 10 -14.698 -6.087 -4.088 1.00 0.85 H ATOM 152 HB2 ASP A 10 -14.926 -8.454 -3.617 1.00 1.54 H ATOM 153 HB3 ASP A 10 -14.452 -8.200 -1.940 1.00 1.00 H ATOM 154 N ASN A 11 -13.407 -5.345 -1.239 1.00 0.71 N ATOM 155 CA ASN A 11 -13.402 -4.397 -0.132 1.00 0.81 C ATOM 156 C ASN A 11 -12.783 -3.086 -0.591 1.00 0.62 C ATOM 157 O ASN A 11 -12.334 -2.275 0.217 1.00 0.71 O ATOM 158 CB ASN A 11 -12.618 -4.959 1.059 1.00 1.00 C ATOM 159 CG ASN A 11 -13.212 -6.240 1.621 1.00 1.72 C ATOM 160 OD1 ASN A 11 -12.484 -7.115 2.096 1.00 2.31 O ATOM 161 ND2 ASN A 11 -14.532 -6.361 1.586 1.00 2.49 N ATOM 162 H ASN A 11 -12.633 -5.933 -1.366 1.00 0.65 H ATOM 163 HA ASN A 11 -14.426 -4.221 0.163 1.00 0.95 H ATOM 164 HB2 ASN A 11 -11.607 -5.164 0.748 1.00 1.31 H ATOM 165 HB3 ASN A 11 -12.601 -4.220 1.846 1.00 1.48 H ATOM 166 HD21 ASN A 11 -15.058 -5.625 1.206 1.00 2.63 H ATOM 167 HD22 ASN A 11 -14.929 -7.179 1.948 1.00 3.19 H ATOM 168 N ALA A 12 -12.784 -2.888 -1.904 1.00 0.42 N ATOM 169 CA ALA A 12 -12.121 -1.755 -2.535 1.00 0.31 C ATOM 170 C ALA A 12 -12.911 -0.458 -2.393 1.00 0.32 C ATOM 171 O ALA A 12 -12.792 0.439 -3.228 1.00 0.40 O ATOM 172 CB ALA A 12 -11.902 -2.056 -4.002 1.00 0.32 C ATOM 173 H ALA A 12 -13.259 -3.530 -2.471 1.00 0.44 H ATOM 174 HA ALA A 12 -11.157 -1.635 -2.070 1.00 0.38 H ATOM 175 HB1 ALA A 12 -12.860 -2.141 -4.492 1.00 1.05 H ATOM 176 HB2 ALA A 12 -11.359 -2.984 -4.102 1.00 0.95 H ATOM 177 HB3 ALA A 12 -11.337 -1.254 -4.451 1.00 1.02 H ATOM 178 N THR A 13 -13.694 -0.359 -1.333 1.00 0.36 N ATOM 179 CA THR A 13 -14.461 0.844 -1.047 1.00 0.43 C ATOM 180 C THR A 13 -13.532 2.046 -0.918 1.00 0.33 C ATOM 181 O THR A 13 -12.360 1.884 -0.581 1.00 0.24 O ATOM 182 CB THR A 13 -15.265 0.682 0.257 1.00 0.56 C ATOM 183 OG1 THR A 13 -14.417 0.164 1.291 1.00 0.59 O ATOM 184 CG2 THR A 13 -16.448 -0.247 0.054 1.00 0.74 C ATOM 185 H THR A 13 -13.741 -1.111 -0.711 1.00 0.41 H ATOM 186 HA THR A 13 -15.153 1.010 -1.860 1.00 0.52 H ATOM 187 HB THR A 13 -15.634 1.651 0.558 1.00 0.61 H ATOM 188 HG1 THR A 13 -14.904 0.152 2.126 1.00 0.81 H ATOM 189 HG21 THR A 13 -17.000 -0.329 0.977 1.00 1.36 H ATOM 190 HG22 THR A 13 -16.093 -1.222 -0.244 1.00 1.35 H ATOM 191 HG23 THR A 13 -17.090 0.156 -0.715 1.00 1.13 H ATOM 192 N PRO A 14 -14.036 3.266 -1.180 1.00 0.40 N ATOM 193 CA PRO A 14 -13.231 4.490 -1.093 1.00 0.38 C ATOM 194 C PRO A 14 -12.470 4.583 0.225 1.00 0.30 C ATOM 195 O PRO A 14 -11.353 5.099 0.279 1.00 0.32 O ATOM 196 CB PRO A 14 -14.271 5.604 -1.186 1.00 0.52 C ATOM 197 CG PRO A 14 -15.415 5.011 -1.928 1.00 0.68 C ATOM 198 CD PRO A 14 -15.427 3.546 -1.585 1.00 0.56 C ATOM 199 HA PRO A 14 -12.536 4.568 -1.917 1.00 0.40 H ATOM 200 HB2 PRO A 14 -14.570 5.910 -0.190 1.00 0.61 H ATOM 201 HB3 PRO A 14 -13.871 6.443 -1.730 1.00 0.65 H ATOM 202 HG2 PRO A 14 -16.338 5.480 -1.612 1.00 0.90 H ATOM 203 HG3 PRO A 14 -15.272 5.139 -2.988 1.00 0.87 H ATOM 204 HD2 PRO A 14 -16.109 3.356 -0.770 1.00 0.63 H ATOM 205 HD3 PRO A 14 -15.701 2.963 -2.448 1.00 0.63 H ATOM 206 N GLU A 15 -13.078 4.051 1.278 1.00 0.34 N ATOM 207 CA GLU A 15 -12.492 4.074 2.607 1.00 0.38 C ATOM 208 C GLU A 15 -11.205 3.252 2.664 1.00 0.32 C ATOM 209 O GLU A 15 -10.168 3.738 3.118 1.00 0.39 O ATOM 210 CB GLU A 15 -13.502 3.544 3.616 1.00 0.53 C ATOM 211 CG GLU A 15 -14.766 4.381 3.696 1.00 0.69 C ATOM 212 CD GLU A 15 -15.822 3.767 4.588 1.00 1.65 C ATOM 213 OE1 GLU A 15 -15.645 3.789 5.825 1.00 1.97 O ATOM 214 OE2 GLU A 15 -16.835 3.266 4.063 1.00 2.44 O ATOM 215 H GLU A 15 -13.950 3.616 1.154 1.00 0.40 H ATOM 216 HA GLU A 15 -12.261 5.098 2.850 1.00 0.43 H ATOM 217 HB2 GLU A 15 -13.777 2.540 3.336 1.00 0.54 H ATOM 218 HB3 GLU A 15 -13.045 3.525 4.591 1.00 0.58 H ATOM 219 HG2 GLU A 15 -14.513 5.356 4.085 1.00 0.96 H ATOM 220 HG3 GLU A 15 -15.174 4.487 2.701 1.00 1.29 H ATOM 221 N LYS A 16 -11.266 2.018 2.182 1.00 0.27 N ATOM 222 CA LYS A 16 -10.124 1.120 2.264 1.00 0.26 C ATOM 223 C LYS A 16 -9.180 1.336 1.092 1.00 0.19 C ATOM 224 O LYS A 16 -7.976 1.105 1.200 1.00 0.25 O ATOM 225 CB LYS A 16 -10.587 -0.334 2.305 1.00 0.30 C ATOM 226 CG LYS A 16 -9.515 -1.286 2.805 1.00 0.44 C ATOM 227 CD LYS A 16 -10.084 -2.660 3.103 1.00 1.16 C ATOM 228 CE LYS A 16 -9.044 -3.566 3.738 1.00 1.17 C ATOM 229 NZ LYS A 16 -9.628 -4.858 4.180 1.00 1.80 N ATOM 230 H LYS A 16 -12.095 1.705 1.759 1.00 0.30 H ATOM 231 HA LYS A 16 -9.596 1.343 3.180 1.00 0.32 H ATOM 232 HB2 LYS A 16 -11.445 -0.408 2.952 1.00 0.38 H ATOM 233 HB3 LYS A 16 -10.871 -0.637 1.308 1.00 0.26 H ATOM 234 HG2 LYS A 16 -8.750 -1.380 2.048 1.00 1.12 H ATOM 235 HG3 LYS A 16 -9.081 -0.882 3.707 1.00 1.12 H ATOM 236 HD2 LYS A 16 -10.917 -2.554 3.781 1.00 1.84 H ATOM 237 HD3 LYS A 16 -10.424 -3.108 2.179 1.00 1.91 H ATOM 238 HE2 LYS A 16 -8.265 -3.762 3.016 1.00 1.60 H ATOM 239 HE3 LYS A 16 -8.621 -3.061 4.594 1.00 1.66 H ATOM 240 HZ1 LYS A 16 -8.904 -5.436 4.652 1.00 2.19 H ATOM 241 HZ2 LYS A 16 -9.999 -5.384 3.366 1.00 2.27 H ATOM 242 HZ3 LYS A 16 -10.406 -4.687 4.851 1.00 2.33 H ATOM 243 N LEU A 17 -9.731 1.782 -0.025 1.00 0.14 N ATOM 244 CA LEU A 17 -8.937 2.090 -1.201 1.00 0.13 C ATOM 245 C LEU A 17 -7.942 3.201 -0.889 1.00 0.15 C ATOM 246 O LEU A 17 -6.758 3.093 -1.203 1.00 0.19 O ATOM 247 CB LEU A 17 -9.855 2.505 -2.352 1.00 0.18 C ATOM 248 CG LEU A 17 -9.163 2.840 -3.674 1.00 0.27 C ATOM 249 CD1 LEU A 17 -8.476 1.615 -4.257 1.00 0.30 C ATOM 250 CD2 LEU A 17 -10.176 3.400 -4.655 1.00 0.36 C ATOM 251 H LEU A 17 -10.709 1.890 -0.067 1.00 0.16 H ATOM 252 HA LEU A 17 -8.397 1.200 -1.477 1.00 0.18 H ATOM 253 HB2 LEU A 17 -10.552 1.700 -2.532 1.00 0.20 H ATOM 254 HB3 LEU A 17 -10.415 3.373 -2.037 1.00 0.21 H ATOM 255 HG LEU A 17 -8.411 3.596 -3.500 1.00 0.29 H ATOM 256 HD11 LEU A 17 -8.179 1.821 -5.275 1.00 1.08 H ATOM 257 HD12 LEU A 17 -9.158 0.778 -4.242 1.00 1.00 H ATOM 258 HD13 LEU A 17 -7.601 1.377 -3.671 1.00 1.02 H ATOM 259 HD21 LEU A 17 -9.684 3.634 -5.586 1.00 1.09 H ATOM 260 HD22 LEU A 17 -10.617 4.295 -4.243 1.00 1.04 H ATOM 261 HD23 LEU A 17 -10.948 2.665 -4.827 1.00 1.12 H ATOM 262 N ALA A 18 -8.426 4.256 -0.247 1.00 0.16 N ATOM 263 CA ALA A 18 -7.572 5.365 0.151 1.00 0.21 C ATOM 264 C ALA A 18 -6.599 4.932 1.240 1.00 0.20 C ATOM 265 O ALA A 18 -5.481 5.433 1.316 1.00 0.23 O ATOM 266 CB ALA A 18 -8.410 6.538 0.628 1.00 0.27 C ATOM 267 H ALA A 18 -9.386 4.293 -0.038 1.00 0.17 H ATOM 268 HA ALA A 18 -7.007 5.682 -0.715 1.00 0.25 H ATOM 269 HB1 ALA A 18 -7.764 7.368 0.870 1.00 1.10 H ATOM 270 HB2 ALA A 18 -8.968 6.248 1.508 1.00 1.03 H ATOM 271 HB3 ALA A 18 -9.096 6.830 -0.152 1.00 1.03 H ATOM 272 N LYS A 19 -7.032 3.997 2.080 1.00 0.19 N ATOM 273 CA LYS A 19 -6.172 3.446 3.122 1.00 0.22 C ATOM 274 C LYS A 19 -5.019 2.674 2.489 1.00 0.22 C ATOM 275 O LYS A 19 -3.872 2.770 2.923 1.00 0.27 O ATOM 276 CB LYS A 19 -6.978 2.526 4.042 1.00 0.29 C ATOM 277 CG LYS A 19 -6.184 1.987 5.219 1.00 0.43 C ATOM 278 CD LYS A 19 -7.003 0.996 6.029 1.00 1.34 C ATOM 279 CE LYS A 19 -6.235 0.498 7.241 1.00 1.73 C ATOM 280 NZ LYS A 19 -6.990 -0.546 7.982 1.00 2.54 N ATOM 281 H LYS A 19 -7.954 3.675 2.001 1.00 0.19 H ATOM 282 HA LYS A 19 -5.772 4.267 3.698 1.00 0.25 H ATOM 283 HB2 LYS A 19 -7.823 3.077 4.427 1.00 0.34 H ATOM 284 HB3 LYS A 19 -7.339 1.688 3.464 1.00 0.28 H ATOM 285 HG2 LYS A 19 -5.299 1.491 4.848 1.00 0.87 H ATOM 286 HG3 LYS A 19 -5.899 2.811 5.857 1.00 1.07 H ATOM 287 HD2 LYS A 19 -7.907 1.480 6.364 1.00 1.98 H ATOM 288 HD3 LYS A 19 -7.253 0.153 5.402 1.00 1.95 H ATOM 289 HE2 LYS A 19 -5.294 0.084 6.912 1.00 2.11 H ATOM 290 HE3 LYS A 19 -6.048 1.332 7.901 1.00 2.03 H ATOM 291 HZ1 LYS A 19 -7.898 -0.163 8.315 1.00 3.08 H ATOM 292 HZ2 LYS A 19 -6.441 -0.870 8.803 1.00 2.94 H ATOM 293 HZ3 LYS A 19 -7.178 -1.360 7.362 1.00 2.86 H HETATM 294 N 0A1 A 20 -5.345 1.917 1.451 1.00 0.20 N HETATM 295 CA 0A1 A 20 -4.354 1.187 0.674 1.00 0.22 C HETATM 296 CB 0A1 A 20 -5.072 0.340 -0.388 1.00 0.23 C HETATM 297 CG 0A1 A 20 -4.178 -0.264 -1.451 1.00 0.26 C HETATM 298 CD1 0A1 A 20 -4.255 0.168 -2.770 1.00 0.31 C HETATM 299 CE1 0A1 A 20 -3.458 -0.384 -3.752 1.00 0.37 C HETATM 300 CZ 0A1 A 20 -2.561 -1.383 -3.425 1.00 0.39 C HETATM 301 OH 0A1 A 20 -1.754 -1.942 -4.405 1.00 0.48 O HETATM 302 CM 0A1 A 20 -2.538 -2.201 -5.579 1.00 0.78 C HETATM 303 CE2 0A1 A 20 -2.463 -1.826 -2.123 1.00 0.38 C HETATM 304 CD2 0A1 A 20 -3.270 -1.268 -1.146 1.00 0.32 C HETATM 305 C 0A1 A 20 -3.369 2.158 0.030 1.00 0.23 C HETATM 306 O 0A1 A 20 -2.158 1.969 0.103 1.00 0.26 O HETATM 307 HN1 0A1 A 20 -6.294 1.840 1.200 1.00 0.19 H HETATM 308 HA 0A1 A 20 -3.815 0.534 1.347 1.00 0.26 H HETATM 309 HBC1 0A1 A 20 -5.803 0.960 -0.886 1.00 0.23 H HETATM 310 HBC2 0A1 A 20 -5.584 -0.474 0.104 1.00 0.26 H HETATM 311 HD1 0A1 A 20 -4.955 0.946 -3.027 1.00 0.34 H HETATM 312 HD2 0A1 A 20 -3.196 -1.614 -0.127 1.00 0.36 H HETATM 313 HE1 0A1 A 20 -3.534 -0.032 -4.770 1.00 0.44 H HETATM 314 HE2 0A1 A 20 -1.764 -2.607 -1.863 1.00 0.45 H HETATM 315 HMC1 0A1 A 20 -2.338 -3.199 -5.939 1.00 1.34 H HETATM 316 HMC2 0A1 A 20 -2.291 -1.483 -6.344 1.00 1.25 H HETATM 317 HMC3 0A1 A 20 -3.587 -2.107 -5.330 1.00 1.48 H ATOM 318 N GLN A 21 -3.904 3.214 -0.569 1.00 0.21 N ATOM 319 CA GLN A 21 -3.087 4.242 -1.205 1.00 0.26 C ATOM 320 C GLN A 21 -2.208 4.955 -0.184 1.00 0.29 C ATOM 321 O GLN A 21 -1.037 5.235 -0.444 1.00 0.34 O ATOM 322 CB GLN A 21 -3.985 5.249 -1.917 1.00 0.27 C ATOM 323 CG GLN A 21 -4.799 4.623 -3.030 1.00 0.30 C ATOM 324 CD GLN A 21 -5.724 5.605 -3.716 1.00 1.32 C ATOM 325 OE1 GLN A 21 -6.209 6.558 -3.105 1.00 1.99 O ATOM 326 NE2 GLN A 21 -5.976 5.375 -4.990 1.00 1.78 N ATOM 327 H GLN A 21 -4.884 3.303 -0.592 1.00 0.19 H ATOM 328 HA GLN A 21 -2.454 3.759 -1.934 1.00 0.28 H ATOM 329 HB2 GLN A 21 -4.667 5.679 -1.196 1.00 0.25 H ATOM 330 HB3 GLN A 21 -3.376 6.033 -2.336 1.00 0.33 H ATOM 331 HG2 GLN A 21 -4.122 4.217 -3.766 1.00 0.95 H ATOM 332 HG3 GLN A 21 -5.394 3.825 -2.611 1.00 0.92 H ATOM 333 HE21 GLN A 21 -5.557 4.592 -5.410 1.00 1.48 H ATOM 334 HE22 GLN A 21 -6.563 5.995 -5.468 1.00 2.56 H ATOM 335 N ALA A 22 -2.781 5.243 0.974 1.00 0.27 N ATOM 336 CA ALA A 22 -2.049 5.896 2.051 1.00 0.33 C ATOM 337 C ALA A 22 -0.917 5.008 2.552 1.00 0.31 C ATOM 338 O ALA A 22 0.186 5.484 2.823 1.00 0.34 O ATOM 339 CB ALA A 22 -2.985 6.251 3.194 1.00 0.38 C ATOM 340 H ALA A 22 -3.731 5.022 1.103 1.00 0.24 H ATOM 341 HA ALA A 22 -1.629 6.811 1.659 1.00 0.36 H ATOM 342 HB1 ALA A 22 -3.780 6.880 2.824 1.00 1.04 H ATOM 343 HB2 ALA A 22 -2.434 6.778 3.959 1.00 1.08 H ATOM 344 HB3 ALA A 22 -3.404 5.345 3.608 1.00 1.13 H ATOM 345 N ASP A 23 -1.191 3.714 2.663 1.00 0.28 N ATOM 346 CA ASP A 23 -0.184 2.762 3.113 1.00 0.28 C ATOM 347 C ASP A 23 0.893 2.597 2.051 1.00 0.24 C ATOM 348 O ASP A 23 2.063 2.382 2.364 1.00 0.24 O ATOM 349 CB ASP A 23 -0.815 1.407 3.432 1.00 0.30 C ATOM 350 CG ASP A 23 0.103 0.537 4.268 1.00 0.36 C ATOM 351 OD1 ASP A 23 0.237 0.810 5.480 1.00 0.57 O ATOM 352 OD2 ASP A 23 0.674 -0.429 3.732 1.00 0.55 O ATOM 353 H ASP A 23 -2.094 3.394 2.447 1.00 0.28 H ATOM 354 HA ASP A 23 0.270 3.159 4.009 1.00 0.31 H ATOM 355 HB2 ASP A 23 -1.736 1.561 3.974 1.00 0.33 H ATOM 356 HB3 ASP A 23 -1.028 0.890 2.506 1.00 0.31 H ATOM 357 N LEU A 24 0.495 2.724 0.787 1.00 0.24 N ATOM 358 CA LEU A 24 1.436 2.681 -0.324 1.00 0.22 C ATOM 359 C LEU A 24 2.446 3.810 -0.219 1.00 0.23 C ATOM 360 O LEU A 24 3.587 3.669 -0.644 1.00 0.22 O ATOM 361 CB LEU A 24 0.713 2.781 -1.666 1.00 0.26 C ATOM 362 CG LEU A 24 -0.086 1.549 -2.080 1.00 0.29 C ATOM 363 CD1 LEU A 24 -0.755 1.794 -3.418 1.00 0.32 C ATOM 364 CD2 LEU A 24 0.810 0.321 -2.149 1.00 0.27 C ATOM 365 H LEU A 24 -0.463 2.839 0.597 1.00 0.27 H ATOM 366 HA LEU A 24 1.960 1.739 -0.279 1.00 0.22 H ATOM 367 HB2 LEU A 24 0.036 3.621 -1.621 1.00 0.30 H ATOM 368 HB3 LEU A 24 1.448 2.977 -2.431 1.00 0.24 H ATOM 369 HG LEU A 24 -0.858 1.363 -1.346 1.00 0.32 H ATOM 370 HD11 LEU A 24 -1.419 2.640 -3.337 1.00 1.15 H ATOM 371 HD12 LEU A 24 -1.318 0.918 -3.703 1.00 1.08 H ATOM 372 HD13 LEU A 24 0.000 1.998 -4.162 1.00 0.97 H ATOM 373 HD21 LEU A 24 1.198 0.099 -1.165 1.00 0.96 H ATOM 374 HD22 LEU A 24 1.633 0.512 -2.823 1.00 0.98 H ATOM 375 HD23 LEU A 24 0.239 -0.522 -2.509 1.00 1.03 H ATOM 376 N ALA A 25 2.020 4.929 0.354 1.00 0.26 N ATOM 377 CA ALA A 25 2.899 6.074 0.534 1.00 0.30 C ATOM 378 C ALA A 25 4.039 5.734 1.485 1.00 0.28 C ATOM 379 O ALA A 25 5.107 6.337 1.436 1.00 0.33 O ATOM 380 CB ALA A 25 2.115 7.273 1.041 1.00 0.37 C ATOM 381 H ALA A 25 1.091 4.983 0.666 1.00 0.28 H ATOM 382 HA ALA A 25 3.313 6.323 -0.428 1.00 0.34 H ATOM 383 HB1 ALA A 25 1.310 7.494 0.355 1.00 1.08 H ATOM 384 HB2 ALA A 25 2.770 8.127 1.115 1.00 1.05 H ATOM 385 HB3 ALA A 25 1.706 7.048 2.016 1.00 1.09 H ATOM 386 N LYS A 26 3.795 4.761 2.346 1.00 0.26 N ATOM 387 CA LYS A 26 4.803 4.282 3.274 1.00 0.28 C ATOM 388 C LYS A 26 5.583 3.132 2.643 1.00 0.22 C ATOM 389 O LYS A 26 6.815 3.129 2.628 1.00 0.22 O ATOM 390 CB LYS A 26 4.141 3.815 4.572 1.00 0.38 C ATOM 391 CG LYS A 26 3.212 4.846 5.197 1.00 0.49 C ATOM 392 CD LYS A 26 3.939 6.141 5.520 1.00 1.26 C ATOM 393 CE LYS A 26 3.019 7.150 6.191 1.00 1.78 C ATOM 394 NZ LYS A 26 1.876 7.541 5.318 1.00 2.48 N ATOM 395 H LYS A 26 2.910 4.344 2.350 1.00 0.26 H ATOM 396 HA LYS A 26 5.480 5.094 3.489 1.00 0.33 H ATOM 397 HB2 LYS A 26 3.566 2.924 4.368 1.00 0.39 H ATOM 398 HB3 LYS A 26 4.911 3.577 5.286 1.00 0.43 H ATOM 399 HG2 LYS A 26 2.412 5.059 4.504 1.00 0.94 H ATOM 400 HG3 LYS A 26 2.800 4.438 6.109 1.00 0.89 H ATOM 401 HD2 LYS A 26 4.763 5.925 6.184 1.00 1.84 H ATOM 402 HD3 LYS A 26 4.318 6.567 4.603 1.00 1.81 H ATOM 403 HE2 LYS A 26 2.631 6.714 7.098 1.00 2.10 H ATOM 404 HE3 LYS A 26 3.591 8.033 6.436 1.00 2.31 H ATOM 405 HZ1 LYS A 26 2.225 7.969 4.438 1.00 2.99 H ATOM 406 HZ2 LYS A 26 1.273 8.234 5.811 1.00 2.94 H ATOM 407 HZ3 LYS A 26 1.298 6.707 5.084 1.00 2.73 H HETATM 408 N 0A1 A 27 4.841 2.171 2.098 1.00 0.21 N HETATM 409 CA 0A1 A 27 5.420 0.989 1.469 1.00 0.19 C HETATM 410 CB 0A1 A 27 4.302 0.048 1.002 1.00 0.23 C HETATM 411 CG 0A1 A 27 4.771 -1.110 0.143 1.00 0.22 C HETATM 412 CD1 0A1 A 27 4.257 -1.294 -1.131 1.00 1.04 C HETATM 413 CE1 0A1 A 27 4.670 -2.340 -1.923 1.00 1.12 C HETATM 414 CZ 0A1 A 27 5.618 -3.232 -1.450 1.00 0.33 C HETATM 415 OH 0A1 A 27 6.043 -4.297 -2.235 1.00 0.42 O HETATM 416 CM 0A1 A 27 5.337 -4.325 -3.483 1.00 0.78 C HETATM 417 CE2 0A1 A 27 6.146 -3.070 -0.187 1.00 1.02 C HETATM 418 CD2 0A1 A 27 5.721 -2.015 0.603 1.00 1.06 C HETATM 419 C 0A1 A 27 6.320 1.362 0.295 1.00 0.15 C HETATM 420 O 0A1 A 27 7.498 1.019 0.282 1.00 0.19 O HETATM 421 HN1 0A1 A 27 3.860 2.254 2.135 1.00 0.23 H HETATM 422 HA 0A1 A 27 6.015 0.480 2.212 1.00 0.24 H HETATM 423 HBC1 0A1 A 27 3.584 0.615 0.428 1.00 0.24 H HETATM 424 HBC2 0A1 A 27 3.808 -0.366 1.868 1.00 0.30 H HETATM 425 HD1 0A1 A 27 3.520 -0.603 -1.505 1.00 1.81 H HETATM 426 HD2 0A1 A 27 6.130 -1.887 1.594 1.00 1.88 H HETATM 427 HE1 0A1 A 27 4.252 -2.459 -2.909 1.00 1.94 H HETATM 428 HE2 0A1 A 27 6.889 -3.764 0.188 1.00 1.79 H HETATM 429 HMC1 0A1 A 27 5.462 -3.381 -3.993 1.00 1.41 H HETATM 430 HMC2 0A1 A 27 4.289 -4.501 -3.298 1.00 1.11 H HETATM 431 HMC3 0A1 A 27 5.728 -5.127 -4.095 1.00 1.38 H ATOM 432 N GLN A 28 5.769 2.076 -0.680 1.00 0.15 N ATOM 433 CA GLN A 28 6.508 2.431 -1.885 1.00 0.22 C ATOM 434 C GLN A 28 7.689 3.342 -1.574 1.00 0.27 C ATOM 435 O GLN A 28 8.700 3.316 -2.276 1.00 0.36 O ATOM 436 CB GLN A 28 5.581 3.089 -2.904 1.00 0.27 C ATOM 437 CG GLN A 28 4.659 2.104 -3.603 1.00 0.37 C ATOM 438 CD GLN A 28 3.762 2.768 -4.629 1.00 0.45 C ATOM 439 OE1 GLN A 28 4.100 3.811 -5.187 1.00 0.72 O ATOM 440 NE2 GLN A 28 2.626 2.151 -4.909 1.00 0.38 N ATOM 441 H GLN A 28 4.840 2.383 -0.584 1.00 0.16 H ATOM 442 HA GLN A 28 6.890 1.514 -2.310 1.00 0.27 H ATOM 443 HB2 GLN A 28 4.972 3.824 -2.398 1.00 0.26 H ATOM 444 HB3 GLN A 28 6.180 3.583 -3.653 1.00 0.35 H ATOM 445 HG2 GLN A 28 5.260 1.359 -4.099 1.00 0.44 H ATOM 446 HG3 GLN A 28 4.038 1.625 -2.860 1.00 0.38 H ATOM 447 HE21 GLN A 28 2.429 1.307 -4.448 1.00 0.46 H ATOM 448 HE22 GLN A 28 2.028 2.558 -5.572 1.00 0.43 H ATOM 449 N LYS A 29 7.563 4.138 -0.519 1.00 0.26 N ATOM 450 CA LYS A 29 8.638 5.011 -0.097 1.00 0.36 C ATOM 451 C LYS A 29 9.847 4.190 0.335 1.00 0.43 C ATOM 452 O LYS A 29 10.950 4.360 -0.188 1.00 0.55 O ATOM 453 CB LYS A 29 8.170 5.896 1.055 1.00 0.38 C ATOM 454 CG LYS A 29 9.238 6.848 1.534 1.00 0.53 C ATOM 455 CD LYS A 29 8.782 7.659 2.734 1.00 0.84 C ATOM 456 CE LYS A 29 9.859 8.633 3.182 1.00 1.50 C ATOM 457 NZ LYS A 29 10.159 9.645 2.134 1.00 2.36 N ATOM 458 H LYS A 29 6.731 4.136 -0.009 1.00 0.23 H ATOM 459 HA LYS A 29 8.913 5.634 -0.934 1.00 0.42 H ATOM 460 HB2 LYS A 29 7.316 6.474 0.732 1.00 0.38 H ATOM 461 HB3 LYS A 29 7.879 5.267 1.883 1.00 0.40 H ATOM 462 HG2 LYS A 29 10.108 6.274 1.810 1.00 0.70 H ATOM 463 HG3 LYS A 29 9.487 7.517 0.728 1.00 0.74 H ATOM 464 HD2 LYS A 29 7.895 8.213 2.465 1.00 1.31 H ATOM 465 HD3 LYS A 29 8.556 6.985 3.547 1.00 1.23 H ATOM 466 HE2 LYS A 29 9.521 9.140 4.073 1.00 1.91 H ATOM 467 HE3 LYS A 29 10.758 8.078 3.403 1.00 2.00 H ATOM 468 HZ1 LYS A 29 10.398 9.176 1.239 1.00 2.75 H ATOM 469 HZ2 LYS A 29 10.964 10.233 2.427 1.00 2.67 H ATOM 470 HZ3 LYS A 29 9.334 10.260 1.982 1.00 2.94 H ATOM 471 N ASP A 30 9.626 3.291 1.286 1.00 0.41 N ATOM 472 CA ASP A 30 10.685 2.415 1.768 1.00 0.52 C ATOM 473 C ASP A 30 11.115 1.446 0.675 1.00 0.49 C ATOM 474 O ASP A 30 12.271 1.053 0.603 1.00 0.61 O ATOM 475 CB ASP A 30 10.228 1.638 3.000 1.00 0.57 C ATOM 476 CG ASP A 30 11.362 0.863 3.642 1.00 0.71 C ATOM 477 OD1 ASP A 30 11.664 -0.249 3.163 1.00 0.75 O ATOM 478 OD2 ASP A 30 11.953 1.353 4.622 1.00 0.94 O ATOM 479 H ASP A 30 8.725 3.214 1.676 1.00 0.37 H ATOM 480 HA ASP A 30 11.529 3.034 2.035 1.00 0.63 H ATOM 481 HB2 ASP A 30 9.832 2.327 3.729 1.00 0.65 H ATOM 482 HB3 ASP A 30 9.455 0.941 2.712 1.00 0.48 H ATOM 483 N LEU A 31 10.171 1.067 -0.176 1.00 0.37 N ATOM 484 CA LEU A 31 10.452 0.168 -1.284 1.00 0.41 C ATOM 485 C LEU A 31 11.453 0.800 -2.244 1.00 0.58 C ATOM 486 O LEU A 31 12.294 0.112 -2.820 1.00 0.65 O ATOM 487 CB LEU A 31 9.160 -0.174 -2.026 1.00 0.39 C ATOM 488 CG LEU A 31 9.277 -1.248 -3.108 1.00 0.55 C ATOM 489 CD1 LEU A 31 9.578 -2.606 -2.492 1.00 1.16 C ATOM 490 CD2 LEU A 31 8.004 -1.302 -3.932 1.00 1.33 C ATOM 491 H LEU A 31 9.251 1.385 -0.043 1.00 0.30 H ATOM 492 HA LEU A 31 10.879 -0.733 -0.876 1.00 0.41 H ATOM 493 HB2 LEU A 31 8.431 -0.504 -1.299 1.00 0.33 H ATOM 494 HB3 LEU A 31 8.792 0.729 -2.490 1.00 0.44 H ATOM 495 HG LEU A 31 10.093 -0.994 -3.768 1.00 1.45 H ATOM 496 HD11 LEU A 31 8.894 -2.790 -1.676 1.00 1.78 H ATOM 497 HD12 LEU A 31 10.592 -2.623 -2.128 1.00 1.78 H ATOM 498 HD13 LEU A 31 9.454 -3.373 -3.242 1.00 1.70 H ATOM 499 HD21 LEU A 31 7.845 -0.347 -4.411 1.00 1.86 H ATOM 500 HD22 LEU A 31 7.166 -1.526 -3.288 1.00 1.86 H ATOM 501 HD23 LEU A 31 8.095 -2.071 -4.684 1.00 2.00 H ATOM 502 N ALA A 32 11.350 2.110 -2.419 1.00 0.66 N ATOM 503 CA ALA A 32 12.311 2.851 -3.223 1.00 0.86 C ATOM 504 C ALA A 32 13.686 2.814 -2.563 1.00 0.94 C ATOM 505 O ALA A 32 14.713 2.744 -3.239 1.00 1.08 O ATOM 506 CB ALA A 32 11.843 4.283 -3.416 1.00 0.96 C ATOM 507 H ALA A 32 10.604 2.593 -1.998 1.00 0.61 H ATOM 508 HA ALA A 32 12.373 2.379 -4.193 1.00 0.91 H ATOM 509 HB1 ALA A 32 12.571 4.825 -4.001 1.00 1.56 H ATOM 510 HB2 ALA A 32 11.727 4.758 -2.454 1.00 1.38 H ATOM 511 HB3 ALA A 32 10.895 4.285 -3.934 1.00 1.28 H ATOM 512 N ASP A 33 13.687 2.848 -1.236 1.00 0.91 N ATOM 513 CA ASP A 33 14.913 2.725 -0.453 1.00 1.06 C ATOM 514 C ASP A 33 15.466 1.305 -0.549 1.00 1.02 C ATOM 515 O ASP A 33 16.676 1.099 -0.622 1.00 1.18 O ATOM 516 CB ASP A 33 14.641 3.097 1.010 1.00 1.12 C ATOM 517 CG ASP A 33 15.797 2.764 1.933 1.00 1.31 C ATOM 518 OD1 ASP A 33 16.808 3.498 1.913 1.00 1.46 O ATOM 519 OD2 ASP A 33 15.707 1.763 2.677 1.00 1.38 O ATOM 520 H ASP A 33 12.833 2.958 -0.765 1.00 0.83 H ATOM 521 HA ASP A 33 15.638 3.410 -0.864 1.00 1.20 H ATOM 522 HB2 ASP A 33 14.452 4.158 1.074 1.00 1.16 H ATOM 523 HB3 ASP A 33 13.767 2.561 1.351 1.00 1.04 H HETATM 524 N 0A1 A 34 14.562 0.335 -0.556 1.00 0.84 N HETATM 525 CA 0A1 A 34 14.920 -1.069 -0.703 1.00 0.82 C HETATM 526 CB 0A1 A 34 13.755 -1.956 -0.250 1.00 0.66 C HETATM 527 CG 0A1 A 34 14.043 -3.443 -0.312 1.00 0.70 C HETATM 528 CD1 0A1 A 34 13.332 -4.270 -1.174 1.00 1.27 C HETATM 529 CE1 0A1 A 34 13.590 -5.626 -1.239 1.00 1.35 C HETATM 530 CZ 0A1 A 34 14.568 -6.179 -0.438 1.00 0.94 C HETATM 531 OH 0A1 A 34 14.815 -7.550 -0.511 1.00 1.11 O HETATM 532 CM 0A1 A 34 15.535 -8.004 0.647 1.00 1.53 C HETATM 533 CE2 0A1 A 34 15.289 -5.371 0.429 1.00 1.52 C HETATM 534 CD2 0A1 A 34 15.024 -4.017 0.487 1.00 1.45 C HETATM 535 C 0A1 A 34 15.289 -1.378 -2.153 1.00 0.88 C HETATM 536 O 0A1 A 34 14.454 -1.826 -2.941 1.00 1.46 O HETATM 537 HN1 0A1 A 34 13.613 0.573 -0.444 1.00 0.74 H HETATM 538 HA 0A1 A 34 15.771 -1.265 -0.075 1.00 0.94 H HETATM 539 HBC1 0A1 A 34 12.905 -1.758 -0.882 1.00 0.60 H HETATM 540 HBC2 0A1 A 34 13.498 -1.710 0.768 1.00 0.69 H HETATM 541 HD1 0A1 A 34 12.564 -3.840 -1.803 1.00 2.06 H HETATM 542 HD2 0A1 A 34 15.587 -3.390 1.162 1.00 2.25 H HETATM 543 HE1 0A1 A 34 13.025 -6.249 -1.917 1.00 2.14 H HETATM 544 HE2 0A1 A 34 16.055 -5.794 1.058 1.00 2.34 H HETATM 545 HMC1 0A1 A 34 15.117 -7.556 1.535 1.00 1.87 H HETATM 546 HMC2 0A1 A 34 16.574 -7.732 0.557 1.00 2.13 H HETATM 547 HMC3 0A1 A 34 15.457 -9.081 0.711 1.00 2.08 H HETATM 548 N NH2 A 35 16.541 -1.129 -2.507 1.00 1.14 N HETATM 549 HN1 NH2 A 35 17.017 -0.773 -1.728 1.00 1.36 H HETATM 550 HN2 NH2 A 35 15.597 -1.389 -2.490 1.00 1.45 H TER 551 NH2 A 35