REMARK Name = BDB058303 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA ILE A 34 -1.495 -1.667 4.772 0.00 0.00 +0.162 C ATOM 2 C ILE A 34 0.002 -2.035 4.985 0.00 0.00 +0.234 C ATOM 3 O ILE A 34 0.752 -1.221 5.544 0.00 0.00 -0.274 OA ATOM 4 N CYS A 1 0.571 -3.196 4.563 0.00 0.00 -0.302 N ATOM 5 H CYS A 1 1.582 -3.131 4.562 0.00 0.00 +0.150 HD ATOM 6 CA CYS A 1 0.056 -4.557 4.694 0.00 0.00 +0.169 C ATOM 7 C CYS A 1 1.114 -5.553 5.259 0.00 0.00 +0.235 C ATOM 8 N LYS A 2 1.967 -5.254 6.267 0.00 0.00 -0.302 N ATOM 9 H LYS A 2 2.504 -6.079 6.525 0.00 0.00 +0.150 HD ATOM 10 CA LYS A 2 2.168 -4.089 7.132 0.00 0.00 +0.159 C ATOM 11 C LYS A 2 3.556 -4.229 7.813 0.00 0.00 +0.234 C ATOM 12 N GLY A 3 4.654 -4.440 7.019 0.00 0.00 -0.305 N ATOM 13 H GLY A 3 5.522 -4.508 7.535 0.00 0.00 +0.149 HD ATOM 14 CA GLY A 3 4.756 -4.192 5.584 0.00 0.00 +0.200 C ATOM 15 C GLY A 3 6.189 -4.359 5.090 0.00 0.00 +0.231 C ATOM 16 N ASN A 4 7.190 -3.628 5.674 0.00 0.00 -0.302 N ATOM 17 H ASN A 4 8.079 -3.768 5.184 0.00 0.00 +0.150 HD ATOM 18 CA ASN A 4 7.036 -2.318 6.324 0.00 0.00 +0.168 C ATOM 19 C ASN A 4 6.941 -1.264 5.194 0.00 0.00 +0.234 C ATOM 20 N GLY A 5 8.002 -0.712 4.554 0.00 0.00 -0.305 N ATOM 21 H GLY A 5 7.696 -0.117 3.795 0.00 0.00 +0.149 HD ATOM 22 CA GLY A 5 9.436 -0.791 4.771 0.00 0.00 +0.200 C ATOM 23 C GLY A 5 10.031 -2.069 4.175 0.00 0.00 +0.231 C ATOM 24 N TYR A 6 10.947 -1.997 3.173 0.00 0.00 -0.302 N ATOM 25 H TYR A 6 11.286 -2.892 2.821 0.00 0.00 +0.150 HD ATOM 26 CA TYR A 6 11.504 -0.808 2.513 0.00 0.00 +0.163 C ATOM 27 C TYR A 6 12.054 -1.208 1.136 0.00 0.00 +0.234 C ATOM 28 N CYS A 7 12.336 -0.265 0.185 0.00 0.00 -0.302 N ATOM 29 H CYS A 7 12.746 -0.772 -0.597 0.00 0.00 +0.150 HD ATOM 30 CA CYS A 7 11.433 0.796 -0.324 0.00 0.00 +0.169 C ATOM 31 CB CYS A 7 10.037 0.267 -0.707 0.00 0.00 +0.112 C ATOM 32 SG CYS A 7 10.153 -0.957 -2.066 0.00 0.00 -0.091 S ATOM 33 SG CYS A 29 8.964 -2.500 -1.422 0.00 0.00 -0.091 S ATOM 34 CB CYS A 29 7.280 -2.035 -1.988 0.00 0.00 +0.112 C ATOM 35 CA CYS A 29 6.965 -2.228 -3.489 0.00 0.00 +0.170 C ATOM 36 C CYS A 29 7.441 -1.012 -4.315 0.00 0.00 +0.237 C ATOM 37 N PRO A 30 6.713 0.163 -4.222 0.00 0.00 -0.288 N ATOM 38 CA PRO A 30 5.390 0.372 -3.609 0.00 0.00 +0.162 C ATOM 39 C PRO A 30 4.289 -0.321 -4.435 0.00 0.00 +0.234 C ATOM 40 N GLY A 31 3.063 -0.566 -3.897 0.00 0.00 -0.305 N ATOM 41 H GLY A 31 2.569 -1.270 -4.445 0.00 0.00 +0.149 HD ATOM 42 CA GLY A 31 2.610 -0.406 -2.524 0.00 0.00 +0.200 C ATOM 43 C GLY A 31 3.101 -1.541 -1.618 0.00 0.00 +0.231 C ATOM 44 N ALA A 32 2.354 -1.919 -0.546 0.00 0.00 -0.303 N ATOM 45 H ALA A 32 2.827 -2.597 0.049 0.00 0.00 +0.149 HD ATOM 46 CA ALA A 32 0.950 -1.660 -0.195 0.00 0.00 +0.156 C ATOM 47 C ALA A 32 0.961 -1.578 1.338 0.00 0.00 +0.234 C ATOM 48 N CYS A 33 0.159 -0.721 2.028 0.00 0.00 -0.302 N ATOM 49 H CYS A 33 0.468 -0.711 2.992 0.00 0.00 +0.150 HD ATOM 50 CA CYS A 33 -1.297 -0.501 1.890 0.00 0.00 +0.169 C ATOM 51 CB CYS A 33 -1.767 0.061 0.538 0.00 0.00 +0.112 C ATOM 52 SG CYS A 33 -3.456 0.767 0.685 0.00 0.00 -0.091 S ATOM 53 SG CYS A 16 -3.115 2.769 1.041 0.00 0.00 -0.091 S ATOM 54 CB CYS A 16 -3.648 3.526 -0.538 0.00 0.00 +0.112 C ATOM 55 CA CYS A 16 -3.865 5.056 -0.505 0.00 0.00 +0.169 C ATOM 56 C CYS A 16 -4.674 5.510 0.733 0.00 0.00 +0.235 C ATOM 57 O CYS A 16 -4.123 6.033 1.704 0.00 0.00 -0.274 OA ATOM 58 N GLN A 17 -6.031 5.374 0.772 0.00 0.00 -0.302 N ATOM 59 H GLN A 17 -6.420 5.717 1.654 0.00 0.00 +0.150 HD ATOM 60 CA GLN A 17 -6.941 4.657 -0.134 0.00 0.00 +0.159 C ATOM 61 C GLN A 17 -7.033 5.361 -1.517 0.00 0.00 +0.234 C ATOM 62 O GLN A 17 -6.577 6.489 -1.728 0.00 0.00 -0.274 OA ATOM 63 N ARG A 18 -7.524 4.636 -2.580 0.00 0.00 -0.302 N ATOM 64 H ARG A 18 -7.112 5.003 -3.433 0.00 0.00 +0.150 HD ATOM 65 CA ARG A 18 -8.974 4.515 -2.840 0.00 0.00 +0.159 C ATOM 66 C ARG A 18 -9.110 3.477 -3.975 0.00 0.00 +0.234 C ATOM 67 O ARG A 18 -8.654 3.710 -5.098 0.00 0.00 -0.274 OA ATOM 68 N ILE A 19 -9.692 2.268 -3.752 0.00 0.00 -0.302 N ATOM 69 H ILE A 19 -9.716 1.671 -4.578 0.00 0.00 +0.150 HD ATOM 70 CA ILE A 19 -10.204 1.674 -2.516 0.00 0.00 +0.162 C ATOM 71 C ILE A 19 -10.111 0.134 -2.677 0.00 0.00 +0.234 C ATOM 72 O ILE A 19 -10.502 -0.425 -3.703 0.00 0.00 -0.274 OA ATOM 73 N LEU A 20 -9.574 -0.653 -1.695 0.00 0.00 -0.302 N ATOM 74 H LEU A 20 -9.520 -1.623 -1.984 0.00 0.00 +0.150 HD ATOM 75 CA LEU A 20 -8.726 -0.220 -0.590 0.00 0.00 +0.159 C ATOM 76 C LEU A 20 -7.350 0.232 -1.144 0.00 0.00 +0.234 C ATOM 77 O LEU A 20 -7.039 1.426 -1.068 0.00 0.00 -0.274 OA ATOM 78 N GLN A 21 -6.477 -0.612 -1.745 0.00 0.00 -0.302 N ATOM 79 H GLN A 21 -5.619 -0.149 -2.044 0.00 0.00 +0.150 HD ATOM 80 CA GLN A 21 -6.495 -2.063 -2.012 0.00 0.00 +0.159 C ATOM 81 C GLN A 21 -5.048 -2.509 -1.678 0.00 0.00 +0.234 C ATOM 82 O GLN A 21 -4.081 -1.968 -2.226 0.00 0.00 -0.274 OA ATOM 83 N GLN A 22 -4.807 -3.405 -0.676 0.00 0.00 -0.302 N ATOM 84 H GLN A 22 -3.812 -3.473 -0.473 0.00 0.00 +0.150 HD ATOM 85 CA GLN A 22 -5.720 -3.876 0.366 0.00 0.00 +0.159 C ATOM 86 C GLN A 22 -4.947 -4.370 1.603 0.00 0.00 +0.234 C ATOM 87 O GLN A 22 -5.170 -3.872 2.712 0.00 0.00 -0.274 OA ATOM 88 N CYS A 23 -4.049 -5.382 1.541 0.00 0.00 -0.302 N ATOM 89 H CYS A 23 -3.761 -5.659 2.476 0.00 0.00 +0.150 HD ATOM 90 CA CYS A 23 -3.691 -6.358 0.493 0.00 0.00 +0.169 C ATOM 91 CB CYS A 23 -2.180 -6.615 0.566 0.00 0.00 +0.112 C ATOM 92 SG CYS A 23 -1.595 -7.564 2.022 0.00 0.00 -0.091 S ATOM 93 SG CYS A 1 -1.832 -6.253 3.583 0.00 0.00 -0.091 S ATOM 94 C CYS A 23 -4.574 -7.626 0.698 0.00 0.00 +0.235 C ATOM 95 O CYS A 23 -5.456 -7.666 1.569 0.00 0.00 -0.274 OA ATOM 96 N GLN A 24 -4.482 -8.724 -0.101 0.00 0.00 -0.302 N ATOM 97 H GLN A 24 -5.254 -9.363 0.070 0.00 0.00 +0.150 HD ATOM 98 CA GLN A 24 -3.779 -8.916 -1.375 0.00 0.00 +0.159 C ATOM 99 C GLN A 24 -4.490 -8.090 -2.462 0.00 0.00 +0.234 C ATOM 100 O GLN A 24 -5.694 -7.841 -2.387 0.00 0.00 -0.274 OA ATOM 101 N GLN A 25 -3.764 -7.622 -3.518 0.00 0.00 -0.302 N ATOM 102 H GLN A 25 -4.235 -6.868 -4.019 0.00 0.00 +0.150 HD ATOM 103 CA GLN A 25 -2.343 -7.865 -3.817 0.00 0.00 +0.159 C ATOM 104 C GLN A 25 -1.448 -6.872 -3.026 0.00 0.00 +0.234 C ATOM 105 O GLN A 25 -1.839 -5.779 -2.617 0.00 0.00 -0.274 OA ATOM 106 N ASP A 26 -0.188 -7.357 -2.727 0.00 0.00 -0.302 N ATOM 107 H ASP A 26 0.130 -8.197 -3.214 0.00 0.00 +0.150 HD ATOM 108 CA ASP A 26 0.883 -6.501 -2.192 0.00 0.00 +0.169 C ATOM 109 C ASP A 26 1.795 -6.076 -3.371 0.00 0.00 +0.235 C ATOM 110 O ASP A 26 1.365 -5.997 -4.521 0.00 0.00 -0.274 OA ATOM 111 N SER A 27 3.094 -5.726 -3.082 0.00 0.00 -0.301 N ATOM 112 H SER A 27 3.445 -5.744 -2.138 0.00 0.00 +0.150 HD ATOM 113 CA SER A 27 4.098 -5.444 -4.134 0.00 0.00 +0.184 C ATOM 114 C SER A 27 3.883 -4.022 -4.716 0.00 0.00 +0.236 C ATOM 115 O SER A 27 2.869 -3.358 -4.462 0.00 0.00 -0.274 OA ATOM 116 N ASP A 28 4.851 -3.416 -5.461 0.00 0.00 -0.302 N ATOM 117 H ASP A 28 4.565 -2.489 -5.791 0.00 0.00 +0.150 HD ATOM 118 CA ASP A 28 6.085 -3.957 -6.032 0.00 0.00 +0.169 C ATOM 119 C ASP A 28 7.172 -4.316 -5.002 0.00 0.00 +0.235 C ATOM 120 O ASP A 28 7.831 -5.352 -5.144 0.00 0.00 -0.274 OA ATOM 121 N CYS A 16 -2.584 5.785 -0.668 0.00 0.00 -0.302 N ATOM 122 H CYS A 16 -1.855 5.237 -1.109 0.00 0.00 +0.150 HD ATOM 123 C PHE A 15 -2.506 7.070 -1.153 0.00 0.00 +0.234 C ATOM 124 CA PHE A 15 -3.392 8.187 -0.565 0.00 0.00 +0.163 C ATOM 125 N PHE A 15 -2.875 8.637 0.746 0.00 0.00 -0.302 N ATOM 126 H PHE A 15 -3.601 8.852 1.425 0.00 0.00 +0.150 HD ATOM 127 C GLY A 14 -1.699 9.263 1.046 0.00 0.00 +0.231 C ATOM 128 CA GLY A 14 -0.471 8.999 0.170 0.00 0.00 +0.200 C ATOM 129 N GLY A 14 0.751 9.554 0.742 0.00 0.00 -0.305 N ATOM 130 H GLY A 14 1.071 9.143 1.610 0.00 0.00 +0.149 HD ATOM 131 C GLY A 13 1.446 10.662 0.369 0.00 0.00 +0.231 C ATOM 132 CA GLY A 13 0.992 11.478 -0.838 0.00 0.00 +0.200 C ATOM 133 N GLY A 13 1.289 10.805 -2.090 0.00 0.00 -0.305 N ATOM 134 H GLY A 13 0.546 10.265 -2.525 0.00 0.00 +0.149 HD ATOM 135 C ASP A 12 2.468 10.667 -2.748 0.00 0.00 +0.234 C ATOM 136 CA ASP A 12 3.763 11.329 -2.228 0.00 0.00 +0.169 C ATOM 137 N ASP A 12 4.853 10.559 -2.849 0.00 0.00 -0.302 N ATOM 138 H ASP A 12 4.677 10.334 -3.829 0.00 0.00 +0.150 HD ATOM 139 C SER A 11 5.580 9.557 -2.275 0.00 0.00 +0.236 C ATOM 140 CA SER A 11 5.909 9.589 -0.766 0.00 0.00 +0.184 C ATOM 141 N SER A 11 6.501 8.319 -0.292 0.00 0.00 -0.301 N ATOM 142 H SER A 11 5.941 7.786 0.362 0.00 0.00 +0.150 HD ATOM 143 C GLY A 10 7.707 7.731 -0.548 0.00 0.00 +0.231 C ATOM 144 CA GLY A 10 8.666 8.317 -1.584 0.00 0.00 +0.200 C ATOM 145 N GLY A 10 8.456 7.652 -2.859 0.00 0.00 -0.305 N ATOM 146 H GLY A 10 7.548 7.841 -3.295 0.00 0.00 +0.149 HD ATOM 147 C SER A 9 9.024 6.501 -3.311 0.00 0.00 +0.236 C ATOM 148 CA SER A 9 10.337 5.997 -2.689 0.00 0.00 +0.184 C ATOM 149 N SER A 9 10.476 4.602 -3.122 0.00 0.00 -0.301 N ATOM 150 H SER A 9 9.878 4.334 -3.900 0.00 0.00 +0.150 HD ATOM 151 C GLY A 8 11.004 3.545 -2.457 0.00 0.00 +0.231 C ATOM 152 CA GLY A 8 11.861 3.750 -1.209 0.00 0.00 +0.200 C ATOM 153 N GLY A 8 11.206 3.296 0.012 0.00 0.00 -0.305 N ATOM 154 H GLY A 8 11.050 4.013 0.716 0.00 0.00 +0.149 HD ATOM 155 O GLY A 8 10.742 2.413 -2.869 0.00 0.00 -0.274 OA ATOM 156 O SER A 9 8.518 5.922 -4.273 0.00 0.00 -0.274 OA ATOM 157 O GLY A 10 7.975 6.665 0.015 0.00 0.00 -0.274 OA ATOM 158 O SER A 11 6.008 8.672 -3.019 0.00 0.00 -0.274 OA ATOM 159 O ASP A 12 2.462 10.030 -3.806 0.00 0.00 -0.274 OA ATOM 160 O GLY A 13 2.486 10.959 0.957 0.00 0.00 -0.274 OA ATOM 161 O GLY A 14 -1.649 10.011 2.022 0.00 0.00 -0.274 OA ATOM 162 O PHE A 15 -1.614 7.321 -1.969 0.00 0.00 -0.274 OA ATOM 163 C CYS A 33 -2.032 -1.823 2.269 0.00 0.00 +0.235 C ATOM 164 O CYS A 33 -2.510 -2.555 1.397 0.00 0.00 -0.274 OA ATOM 165 O ALA A 32 1.748 -2.277 1.994 0.00 0.00 -0.274 OA ATOM 166 CB ALA A 32 0.110 -2.826 -0.688 0.00 0.00 +0.038 C ATOM 167 O GLY A 31 4.200 -2.076 -1.772 0.00 0.00 -0.274 OA ATOM 168 O PRO A 30 4.488 -0.728 -5.589 0.00 0.00 -0.274 OA ATOM 169 CB PRO A 30 5.214 1.889 -3.611 0.00 0.00 +0.033 C ATOM 170 CG PRO A 30 6.011 2.338 -4.832 0.00 0.00 +0.021 C ATOM 171 CD PRO A 30 7.189 1.376 -4.865 0.00 0.00 +0.109 C ATOM 172 O CYS A 29 8.442 -1.087 -5.033 0.00 0.00 -0.274 OA ATOM 173 N CYS A 29 7.517 -3.503 -3.973 0.00 0.00 -0.302 N ATOM 174 H CYS A 29 8.386 -3.793 -3.534 0.00 0.00 +0.150 HD ATOM 175 C CYS A 7 11.248 2.049 0.566 0.00 0.00 +0.235 C ATOM 176 O CYS A 7 11.046 1.971 1.781 0.00 0.00 -0.274 OA ATOM 177 O TYR A 6 12.361 -2.380 0.886 0.00 0.00 -0.274 OA ATOM 178 O GLY A 5 9.662 -3.178 4.574 0.00 0.00 -0.274 OA ATOM 179 O ASN A 4 5.827 -1.000 4.718 0.00 0.00 -0.274 OA ATOM 180 O GLY A 3 6.463 -5.132 4.170 0.00 0.00 -0.274 OA ATOM 181 O LYS A 2 3.732 -4.126 9.027 0.00 0.00 -0.274 OA ATOM 182 O CYS A 1 1.159 -6.728 4.876 0.00 0.00 -0.274 OA ATOM 183 CB CYS A 1 -0.420 -5.109 3.337 0.00 0.00 +0.112 C ATOM 184 N ILE A 34 -2.090 -2.257 3.569 0.00 0.00 -0.302 N ATOM 185 H ILE A 34 -2.624 -3.116 3.663 0.00 0.00 +0.150 HD ENDROOT BRANCH 70 186 ATOM 186 CB ILE A 19 -11.644 2.168 -2.214 0.00 0.00 +0.015 C ATOM 187 CG2 ILE A 19 -12.659 1.801 -3.307 0.00 0.00 +0.010 C BRANCH 186 188 ATOM 188 CG1 ILE A 19 -12.113 1.700 -0.827 0.00 0.00 +0.002 C ATOM 189 CD1 ILE A 19 -13.339 2.450 -0.317 0.00 0.00 +0.004 C ENDBRANCH 186 188 ENDBRANCH 70 186 BRANCH 1 190 ATOM 190 CB ILE A 34 -2.414 -1.755 6.023 0.00 0.00 +0.015 C ATOM 191 CG2 ILE A 34 -2.794 -3.172 6.460 0.00 0.00 +0.010 C BRANCH 190 193 ATOM 192 CD1 ILE A 34 -2.778 -0.751 8.364 0.00 0.00 +0.004 C ATOM 193 CG1 ILE A 34 -1.820 -0.937 7.197 0.00 0.00 +0.002 C ENDBRANCH 190 193 ENDBRANCH 1 190 BRANCH 136 194 ATOM 194 CB ASP A 12 3.785 12.784 -2.676 0.00 0.00 +0.152 C BRANCH 194 195 ATOM 195 CG ASP A 12 4.935 13.525 -2.048 0.00 0.00 +0.307 C ATOM 196 OD1 ASP A 12 6.048 13.604 -2.545 0.00 0.00 -0.251 OA BRANCH 195 197 ATOM 197 OD2 ASP A 12 4.647 14.092 -0.857 0.00 0.00 -0.481 OA ATOM 198 HD2 ASP A 12 3.771 13.878 -0.487 0.00 0.00 +0.295 HD ENDBRANCH 195 197 ENDBRANCH 194 195 ENDBRANCH 136 194 BRANCH 10 199 ATOM 199 CB LYS A 2 1.034 -3.905 8.146 0.00 0.00 +0.032 C BRANCH 199 200 ATOM 200 CG LYS A 2 0.643 -5.179 8.904 0.00 0.00 +0.003 C BRANCH 200 201 ATOM 201 CD LYS A 2 -0.450 -4.888 9.940 0.00 0.00 +0.015 C BRANCH 201 202 ATOM 202 CE LYS A 2 -0.917 -6.146 10.675 0.00 0.00 +0.077 C BRANCH 202 203 ATOM 203 NZ LYS A 2 -1.616 -7.059 9.780 0.00 0.00 -0.330 NA ATOM 204 HZ1 LYS A 2 -1.905 -7.886 10.305 0.00 0.00 +0.118 HD ATOM 205 HZ2 LYS A 2 -2.471 -6.624 9.442 0.00 0.00 +0.118 HD ENDBRANCH 202 203 ENDBRANCH 201 202 ENDBRANCH 200 201 ENDBRANCH 199 200 ENDBRANCH 10 199 BRANCH 75 206 ATOM 206 CB LEU A 20 -8.592 -1.268 0.524 0.00 0.00 +0.034 C BRANCH 206 207 ATOM 207 CG LEU A 20 -9.639 -1.232 1.658 0.00 0.00 -0.015 C ATOM 208 CD2 LEU A 20 -9.628 0.086 2.434 0.00 0.00 +0.007 C ATOM 209 CD1 LEU A 20 -11.045 -1.569 1.173 0.00 0.00 +0.007 C ENDBRANCH 206 207 ENDBRANCH 75 206 BRANCH 18 210 ATOM 210 CB ASN A 4 8.062 -2.160 7.433 0.00 0.00 +0.127 C BRANCH 210 211 ATOM 211 CG ASN A 4 8.024 -0.805 8.092 0.00 0.00 +0.213 C ATOM 212 OD1 ASN A 4 7.364 0.144 7.691 0.00 0.00 -0.276 OA ATOM 213 ND2 ASN A 4 8.849 -0.689 9.169 0.00 0.00 -0.329 N ATOM 214 HD21 ASN A 4 8.847 0.194 9.670 0.00 0.00 +0.145 HD ATOM 215 HD22 ASN A 4 9.276 -1.490 9.619 0.00 0.00 +0.145 HD ENDBRANCH 210 211 ENDBRANCH 18 210 BRANCH 80 216 ATOM 216 CB GLN A 21 -6.867 -2.320 -3.485 0.00 0.00 +0.041 C BRANCH 216 217 ATOM 217 CG GLN A 21 -7.632 -3.631 -3.708 0.00 0.00 +0.098 C BRANCH 217 218 ATOM 218 CD GLN A 21 -6.780 -4.876 -3.603 0.00 0.00 +0.211 C ATOM 219 OE1 GLN A 21 -5.561 -4.891 -3.736 0.00 0.00 -0.276 OA ATOM 220 NE2 GLN A 21 -7.483 -6.026 -3.374 0.00 0.00 -0.329 N ATOM 221 HE21 GLN A 21 -6.919 -6.835 -3.111 0.00 0.00 +0.145 HD ATOM 222 HE22 GLN A 21 -8.390 -6.011 -2.921 0.00 0.00 +0.145 HD ENDBRANCH 217 218 ENDBRANCH 216 217 ENDBRANCH 80 216 BRANCH 60 223 ATOM 223 CB GLN A 17 -8.298 4.399 0.544 0.00 0.00 +0.041 C BRANCH 223 224 ATOM 224 CG GLN A 17 -9.202 5.628 0.689 0.00 0.00 +0.098 C BRANCH 224 225 ATOM 225 CD GLN A 17 -8.789 6.569 1.794 0.00 0.00 +0.211 C ATOM 226 OE1 GLN A 17 -7.897 6.325 2.598 0.00 0.00 -0.276 OA ATOM 227 NE2 GLN A 17 -9.512 7.723 1.846 0.00 0.00 -0.329 N ATOM 228 HE21 GLN A 17 -10.074 8.047 1.070 0.00 0.00 +0.145 HD ATOM 229 HE22 GLN A 17 -9.211 8.414 2.524 0.00 0.00 +0.145 HD ENDBRANCH 224 225 ENDBRANCH 223 224 ENDBRANCH 60 223 BRANCH 26 230 ATOM 230 CB TYR A 6 12.610 -0.126 3.353 0.00 0.00 +0.067 C BRANCH 230 231 ATOM 231 CG TYR A 6 13.802 -1.010 3.663 0.00 0.00 -0.045 A ATOM 232 CD2 TYR A 6 14.882 -1.075 2.769 0.00 0.00 +0.007 A ATOM 233 CE2 TYR A 6 15.952 -1.940 3.008 0.00 0.00 +0.045 A ATOM 234 CZ TYR A 6 15.950 -2.733 4.152 0.00 0.00 +0.117 A ATOM 235 CE1 TYR A 6 14.902 -2.658 5.062 0.00 0.00 +0.045 A ATOM 236 CD1 TYR A 6 13.826 -1.803 4.818 0.00 0.00 +0.007 A BRANCH 234 237 ATOM 237 OH TYR A 6 16.963 -3.604 4.415 0.00 0.00 -0.507 OA ATOM 238 HH TYR A 6 17.523 -3.665 3.620 0.00 0.00 +0.292 HD ENDBRANCH 234 237 ENDBRANCH 230 231 ENDBRANCH 26 230 BRANCH 124 239 ATOM 239 CB PHE A 15 -3.571 9.354 -1.556 0.00 0.00 +0.067 C BRANCH 239 240 ATOM 240 CG PHE A 15 -4.694 10.285 -1.157 0.00 0.00 -0.045 A ATOM 241 CD2 PHE A 15 -4.444 11.427 -0.383 0.00 0.00 +0.004 A ATOM 242 CE2 PHE A 15 -5.491 12.260 0.009 0.00 0.00 +0.000 A ATOM 243 CZ PHE A 15 -6.803 11.955 -0.352 0.00 0.00 +0.000 A ATOM 244 CE1 PHE A 15 -7.066 10.816 -1.110 0.00 0.00 +0.000 A ATOM 245 CD1 PHE A 15 -6.018 9.986 -1.512 0.00 0.00 +0.004 A ENDBRANCH 239 240 ENDBRANCH 124 239 BRANCH 85 246 ATOM 246 CB GLN A 22 -6.695 -4.931 -0.144 0.00 0.00 +0.041 C BRANCH 246 247 ATOM 247 CG GLN A 22 -7.750 -5.338 0.875 0.00 0.00 +0.098 C BRANCH 247 248 ATOM 248 CD GLN A 22 -8.525 -6.496 0.297 0.00 0.00 +0.211 C ATOM 249 OE1 GLN A 22 -9.254 -6.393 -0.690 0.00 0.00 -0.276 OA ATOM 250 NE2 GLN A 22 -8.287 -7.689 0.897 0.00 0.00 -0.329 N ATOM 251 HE21 GLN A 22 -8.717 -8.509 0.477 0.00 0.00 +0.145 HD ATOM 252 HE22 GLN A 22 -7.407 -7.838 1.393 0.00 0.00 +0.145 HD ENDBRANCH 247 248 ENDBRANCH 246 247 ENDBRANCH 85 246 BRANCH 140 253 ATOM 253 CB SER A 11 6.748 10.824 -0.401 0.00 0.00 +0.187 C BRANCH 253 254 ATOM 254 OG SER A 11 5.931 11.787 0.264 0.00 0.00 -0.393 OA ATOM 255 H SER A 11 6.425 12.630 0.269 0.00 0.00 +0.209 HD ENDBRANCH 253 254 ENDBRANCH 140 253 BRANCH 148 256 ATOM 256 CB SER A 9 11.486 6.871 -3.210 0.00 0.00 +0.187 C BRANCH 256 257 ATOM 257 OG SER A 9 12.633 6.763 -2.363 0.00 0.00 -0.393 OA ATOM 258 H SER A 9 13.295 7.379 -2.717 0.00 0.00 +0.209 HD ENDBRANCH 256 257 ENDBRANCH 148 256 BRANCH 98 259 ATOM 259 CB GLN A 24 -3.737 -10.406 -1.740 0.00 0.00 +0.041 C BRANCH 259 260 ATOM 260 CG GLN A 24 -2.728 -11.151 -0.865 0.00 0.00 +0.098 C BRANCH 260 261 ATOM 261 CD GLN A 24 -2.739 -12.639 -1.125 0.00 0.00 +0.211 C ATOM 262 OE1 GLN A 24 -3.412 -13.192 -1.983 0.00 0.00 -0.276 OA ATOM 263 NE2 GLN A 24 -1.919 -13.348 -0.301 0.00 0.00 -0.329 N ATOM 264 HE21 GLN A 24 -1.836 -14.341 -0.463 0.00 0.00 +0.145 HD ATOM 265 HE22 GLN A 24 -1.216 -12.902 0.273 0.00 0.00 +0.145 HD ENDBRANCH 260 261 ENDBRANCH 259 260 ENDBRANCH 98 259 BRANCH 118 266 ATOM 266 CB ASP A 28 6.708 -3.020 -7.069 0.00 0.00 +0.152 C BRANCH 266 267 ATOM 267 CG ASP A 28 6.226 -3.357 -8.447 0.00 0.00 +0.307 C ATOM 268 OD1 ASP A 28 5.521 -2.667 -9.160 0.00 0.00 -0.251 OA BRANCH 267 269 ATOM 269 OD2 ASP A 28 6.674 -4.550 -8.885 0.00 0.00 -0.481 OA ATOM 270 HD2 ASP A 28 6.288 -4.639 -9.781 0.00 0.00 +0.295 HD ENDBRANCH 267 269 ENDBRANCH 266 267 ENDBRANCH 118 266 BRANCH 113 271 ATOM 271 CB SER A 27 4.185 -6.583 -5.169 0.00 0.00 +0.187 C BRANCH 271 272 ATOM 272 OG SER A 27 3.243 -6.470 -6.234 0.00 0.00 -0.393 OA ATOM 273 H SER A 27 2.381 -6.232 -5.822 0.00 0.00 +0.209 HD ENDBRANCH 271 272 ENDBRANCH 113 271 BRANCH 103 274 ATOM 274 CB GLN A 25 -2.133 -7.816 -5.337 0.00 0.00 +0.041 C BRANCH 274 275 ATOM 275 CG GLN A 25 -0.762 -8.239 -5.867 0.00 0.00 +0.098 C BRANCH 275 276 ATOM 276 CD GLN A 25 -0.288 -9.568 -5.334 0.00 0.00 +0.211 C ATOM 277 OE1 GLN A 25 -0.001 -9.738 -4.150 0.00 0.00 -0.276 OA ATOM 278 NE2 GLN A 25 -0.233 -10.593 -6.224 0.00 0.00 -0.329 N ATOM 279 HE21 GLN A 25 -0.184 -10.415 -7.221 0.00 0.00 +0.145 HD ATOM 280 HE22 GLN A 25 0.190 -11.454 -5.899 0.00 0.00 +0.145 HD ENDBRANCH 275 276 ENDBRANCH 274 275 ENDBRANCH 103 274 BRANCH 108 281 ATOM 281 CB ASP A 26 1.569 -7.173 -1.004 0.00 0.00 +0.152 C BRANCH 281 282 ATOM 282 CG ASP A 26 2.303 -8.426 -1.379 0.00 0.00 +0.307 C ATOM 283 OD1 ASP A 26 2.835 -8.675 -2.445 0.00 0.00 -0.251 OA BRANCH 282 284 ATOM 284 OD2 ASP A 26 2.384 -9.301 -0.358 0.00 0.00 -0.481 OA ATOM 285 HD2 ASP A 26 2.942 -10.027 -0.707 0.00 0.00 +0.295 HD ENDBRANCH 282 284 ENDBRANCH 281 282 ENDBRANCH 108 281 BRANCH 65 286 ATOM 286 CB ARG A 18 -9.540 5.877 -3.307 0.00 0.00 +0.033 C BRANCH 286 287 ATOM 287 CG ARG A 18 -11.066 5.948 -3.363 0.00 0.00 +0.023 C BRANCH 287 288 ATOM 288 CD ARG A 18 -11.698 6.128 -1.982 0.00 0.00 +0.115 C BRANCH 288 289 ATOM 289 NE ARG A 18 -13.144 6.209 -2.083 0.00 0.00 -0.356 N ATOM 290 HE ARG A 18 -13.551 5.436 -2.601 0.00 0.00 +0.162 HD BRANCH 289 291 ATOM 291 CZ ARG A 18 -13.756 7.385 -2.348 0.00 0.00 +0.188 C ATOM 292 NH1 ARG A 18 -13.187 8.531 -2.316 0.00 0.00 -0.269 NA ATOM 293 HH1 ARG A 18 -13.859 9.255 -2.579 0.00 0.00 +0.190 HD BRANCH 291 294 ATOM 294 NH2 ARG A 18 -15.056 7.206 -2.652 0.00 0.00 -0.370 N ATOM 295 HH21 ARG A 18 -15.612 8.052 -2.662 0.00 0.00 +0.159 HD ATOM 296 HH22 ARG A 18 -15.500 6.499 -2.076 0.00 0.00 +0.159 HD ENDBRANCH 291 294 ENDBRANCH 289 291 ENDBRANCH 288 289 ENDBRANCH 287 288 ENDBRANCH 286 287 ENDBRANCH 65 286 TORSDOF 54