REMARK Name = BDB050534 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA SER A 10 7.602 -2.445 1.397 0.00 0.00 +0.184 C ENDROOT BRANCH 1 2 ATOM 2 N SER A 10 7.531 -1.519 0.261 0.00 0.00 -0.301 N ATOM 3 H SER A 10 8.417 -1.224 -0.147 0.00 0.00 +0.150 HD ATOM 4 C LYS A 9 6.460 -1.146 -0.495 0.00 0.00 +0.234 C ATOM 5 O LYS A 9 6.689 -0.433 -1.478 0.00 0.00 -0.274 OA BRANCH 4 6 ATOM 6 CA LYS A 9 5.017 -1.475 -0.058 0.00 0.00 +0.159 C BRANCH 6 7 ATOM 7 N LYS A 9 4.495 -0.274 0.605 0.00 0.00 -0.302 N ATOM 8 H LYS A 9 4.357 0.554 0.018 0.00 0.00 +0.150 HD ATOM 9 C ARG A 8 4.307 -0.150 1.959 0.00 0.00 +0.234 C ATOM 10 O ARG A 8 4.509 -1.065 2.756 0.00 0.00 -0.274 OA BRANCH 9 11 ATOM 11 CA ARG A 8 3.688 1.200 2.381 0.00 0.00 +0.159 C BRANCH 11 12 ATOM 12 N ARG A 8 2.264 0.976 2.588 0.00 0.00 -0.302 N ATOM 13 H ARG A 8 1.990 0.197 3.178 0.00 0.00 +0.150 HD ATOM 14 C ALA A 7 1.325 1.968 2.395 0.00 0.00 +0.234 C ATOM 15 O ALA A 7 1.600 3.065 1.914 0.00 0.00 -0.274 OA BRANCH 14 16 ATOM 16 CA ALA A 7 -0.127 1.488 2.623 0.00 0.00 +0.156 C ATOM 17 CB ALA A 7 -1.103 2.652 2.765 0.00 0.00 +0.038 C BRANCH 16 18 ATOM 18 N ALA A 7 -0.255 0.485 3.683 0.00 0.00 -0.303 N ATOM 19 H ALA A 7 -0.820 -0.337 3.465 0.00 0.00 +0.149 HD ATOM 20 C THR A 6 -0.133 0.789 5.029 0.00 0.00 +0.236 C ATOM 21 O THR A 6 0.275 1.885 5.404 0.00 0.00 -0.274 OA BRANCH 20 22 ATOM 22 CA THR A 6 -0.693 -0.302 5.979 0.00 0.00 +0.187 C BRANCH 22 23 ATOM 23 N THR A 6 -0.097 -1.625 5.737 0.00 0.00 -0.300 N ATOM 24 H THR A 6 0.605 -1.881 6.429 0.00 0.00 +0.150 HD ATOM 25 C GLN A 5 -0.405 -2.452 4.690 0.00 0.00 +0.234 C ATOM 26 O GLN A 5 -1.158 -2.099 3.786 0.00 0.00 -0.274 OA BRANCH 25 27 ATOM 27 CA GLN A 5 0.275 -3.844 4.702 0.00 0.00 +0.159 C BRANCH 27 28 ATOM 28 N GLN A 5 0.016 -4.479 3.402 0.00 0.00 -0.302 N ATOM 29 H GLN A 5 -0.639 -4.011 2.785 0.00 0.00 +0.150 HD ATOM 30 C LYS A 4 0.278 -5.812 3.186 0.00 0.00 +0.234 C ATOM 31 O LYS A 4 0.648 -6.543 4.105 0.00 0.00 -0.274 OA BRANCH 30 32 ATOM 32 CA LYS A 4 -0.013 -6.330 1.758 0.00 0.00 +0.159 C BRANCH 32 33 ATOM 33 N LYS A 4 0.646 -5.507 0.730 0.00 0.00 -0.302 N ATOM 34 H LYS A 4 1.486 -5.931 0.353 0.00 0.00 +0.150 HD ATOM 35 C THR A 3 0.173 -4.590 -0.151 0.00 0.00 +0.236 C ATOM 36 O THR A 3 0.845 -4.458 -1.187 0.00 0.00 -0.274 OA BRANCH 35 37 ATOM 37 CA THR A 3 -0.953 -3.580 0.136 0.00 0.00 +0.187 C BRANCH 37 38 ATOM 38 N THR A 3 -2.012 -3.956 1.083 0.00 0.00 -0.300 N ATOM 39 H THR A 3 -2.304 -4.933 1.045 0.00 0.00 +0.150 HD ATOM 40 C ARG A 2 -3.118 -3.115 1.257 0.00 0.00 +0.234 C ATOM 41 O ARG A 2 -3.107 -1.919 0.962 0.00 0.00 -0.274 OA BRANCH 40 42 ATOM 42 CA ARG A 2 -4.389 -3.828 1.780 0.00 0.00 +0.159 C BRANCH 42 43 ATOM 43 N ARG A 2 -4.084 -4.419 3.078 0.00 0.00 -0.303 N ATOM 44 H ARG A 2 -4.066 -3.834 3.910 0.00 0.00 +0.149 HD ATOM 45 C ALA A 1 -3.606 -5.695 3.247 0.00 0.00 +0.230 C ATOM 46 O ALA A 1 -3.393 -6.443 2.298 0.00 0.00 -0.274 OA BRANCH 45 47 ATOM 47 CA ALA A 1 -3.273 -6.042 4.716 0.00 0.00 +0.135 C ATOM 48 CB ALA A 1 -3.521 -7.513 5.011 0.00 0.00 +0.033 C BRANCH 47 49 ATOM 49 N ALA A 1 -4.044 -5.177 5.640 0.00 0.00 -0.320 NA ATOM 50 H1 ALA A 1 -3.777 -5.407 6.599 0.00 0.00 +0.119 HD ATOM 51 H2 ALA A 1 -5.032 -5.438 5.574 0.00 0.00 +0.119 HD ENDBRANCH 47 49 ENDBRANCH 45 47 ENDBRANCH 42 43 BRANCH 42 52 ATOM 52 CB ARG A 2 -5.602 -2.900 1.927 0.00 0.00 +0.033 C BRANCH 52 53 ATOM 53 CG ARG A 2 -6.212 -2.325 0.636 0.00 0.00 +0.023 C BRANCH 53 54 ATOM 54 CD ARG A 2 -6.593 -3.361 -0.422 0.00 0.00 +0.115 C BRANCH 54 55 ATOM 55 NE ARG A 2 -7.778 -2.946 -1.157 0.00 0.00 -0.356 N ATOM 56 HE ARG A 2 -8.619 -2.935 -0.592 0.00 0.00 +0.162 HD BRANCH 55 57 ATOM 57 CZ ARG A 2 -7.776 -2.001 -2.126 0.00 0.00 +0.188 C ATOM 58 NH1 ARG A 2 -6.739 -1.438 -2.633 0.00 0.00 -0.269 NA ATOM 59 HH1 ARG A 2 -7.053 -0.780 -3.354 0.00 0.00 +0.190 HD BRANCH 57 60 ATOM 60 NH2 ARG A 2 -9.023 -1.742 -2.553 0.00 0.00 -0.370 N ATOM 61 HH21 ARG A 2 -9.590 -2.579 -2.628 0.00 0.00 +0.159 HD ATOM 62 HH22 ARG A 2 -9.088 -1.202 -3.412 0.00 0.00 +0.159 HD ENDBRANCH 57 60 ENDBRANCH 55 57 ENDBRANCH 54 55 ENDBRANCH 53 54 ENDBRANCH 52 53 ENDBRANCH 42 52 ENDBRANCH 40 42 ENDBRANCH 37 38 BRANCH 37 63 ATOM 63 CB THR A 3 -0.284 -2.183 0.370 0.00 0.00 +0.141 C ATOM 64 CG2 THR A 3 1.075 -2.160 1.062 0.00 0.00 +0.040 C BRANCH 63 65 ATOM 65 OG1 THR A 3 -0.145 -1.512 -0.902 0.00 0.00 -0.390 OA ATOM 66 HG1 THR A 3 0.536 -2.005 -1.404 0.00 0.00 +0.210 HD ENDBRANCH 63 65 ENDBRANCH 37 63 ENDBRANCH 35 37 ENDBRANCH 32 33 BRANCH 32 67 ATOM 67 CB LYS A 4 0.464 -7.793 1.639 0.00 0.00 +0.032 C BRANCH 67 68 ATOM 68 CG LYS A 4 0.043 -8.457 0.320 0.00 0.00 +0.003 C BRANCH 68 69 ATOM 69 CD LYS A 4 0.555 -9.902 0.244 0.00 0.00 +0.015 C BRANCH 69 70 ATOM 70 CE LYS A 4 0.070 -10.647 -1.000 0.00 0.00 +0.077 C BRANCH 70 71 ATOM 71 NZ LYS A 4 0.538 -10.009 -2.224 0.00 0.00 -0.330 NA ATOM 72 HZ1 LYS A 4 1.556 -9.975 -2.233 0.00 0.00 +0.118 HD ATOM 73 HZ2 LYS A 4 0.267 -10.575 -3.032 0.00 0.00 +0.118 HD ENDBRANCH 70 71 ENDBRANCH 69 70 ENDBRANCH 68 69 ENDBRANCH 67 68 ENDBRANCH 32 67 ENDBRANCH 30 32 ENDBRANCH 27 28 BRANCH 27 74 ATOM 74 CB GLN A 5 1.794 -3.763 4.978 0.00 0.00 +0.041 C BRANCH 74 75 ATOM 75 CG GLN A 5 2.145 -4.481 6.280 0.00 0.00 +0.098 C BRANCH 75 76 ATOM 76 CD GLN A 5 3.543 -4.181 6.765 0.00 0.00 +0.211 C ATOM 77 OE1 GLN A 5 3.765 -3.707 7.877 0.00 0.00 -0.276 OA ATOM 78 NE2 GLN A 5 4.563 -4.508 5.923 0.00 0.00 -0.329 N ATOM 79 HE21 GLN A 5 5.500 -4.265 6.228 0.00 0.00 +0.145 HD ATOM 80 HE22 GLN A 5 4.422 -4.798 4.964 0.00 0.00 +0.145 HD ENDBRANCH 75 76 ENDBRANCH 74 75 ENDBRANCH 27 74 ENDBRANCH 25 27 ENDBRANCH 22 23 BRANCH 22 81 ATOM 81 CB THR A 6 -0.470 0.093 7.459 0.00 0.00 +0.141 C ATOM 82 CG2 THR A 6 -1.527 -0.524 8.369 0.00 0.00 +0.040 C BRANCH 81 83 ATOM 83 OG1 THR A 6 0.806 -0.424 7.884 0.00 0.00 -0.390 OA ATOM 84 HG1 THR A 6 1.065 0.051 8.698 0.00 0.00 +0.210 HD ENDBRANCH 81 83 ENDBRANCH 22 81 ENDBRANCH 20 22 ENDBRANCH 16 18 ENDBRANCH 14 16 ENDBRANCH 11 12 BRANCH 11 85 ATOM 85 CB ARG A 8 4.350 1.751 3.650 0.00 0.00 +0.033 C BRANCH 85 86 ATOM 86 CG ARG A 8 4.744 3.225 3.469 0.00 0.00 +0.023 C BRANCH 86 87 ATOM 87 CD ARG A 8 5.237 3.866 4.763 0.00 0.00 +0.115 C BRANCH 87 88 ATOM 88 NE ARG A 8 4.125 4.107 5.668 0.00 0.00 -0.356 N ATOM 89 HE ARG A 8 3.292 4.444 5.195 0.00 0.00 +0.162 HD BRANCH 88 90 ATOM 90 CZ ARG A 8 4.335 4.738 6.847 0.00 0.00 +0.188 C ATOM 91 NH1 ARG A 8 5.483 4.960 7.370 0.00 0.00 -0.269 NA ATOM 92 HH1 ARG A 8 5.368 5.471 8.245 0.00 0.00 +0.190 HD BRANCH 90 93 ATOM 93 NH2 ARG A 8 3.174 5.115 7.412 0.00 0.00 -0.370 N ATOM 94 HH21 ARG A 8 3.233 5.376 8.387 0.00 0.00 +0.159 HD ATOM 95 HH22 ARG A 8 2.441 4.422 7.265 0.00 0.00 +0.159 HD ENDBRANCH 90 93 ENDBRANCH 88 90 ENDBRANCH 87 88 ENDBRANCH 86 87 ENDBRANCH 85 86 ENDBRANCH 11 85 ENDBRANCH 9 11 ENDBRANCH 6 7 BRANCH 6 96 ATOM 96 CB LYS A 9 4.129 -1.770 -1.283 0.00 0.00 +0.032 C BRANCH 96 97 ATOM 97 CG LYS A 9 4.199 -3.208 -1.804 0.00 0.00 +0.003 C BRANCH 97 98 ATOM 98 CD LYS A 9 5.463 -3.515 -2.611 0.00 0.00 +0.015 C BRANCH 98 99 ATOM 99 CE LYS A 9 5.429 -4.945 -3.154 0.00 0.00 +0.077 C BRANCH 99 100 ATOM 100 NZ LYS A 9 6.595 -5.218 -3.988 0.00 0.00 -0.330 NA ATOM 101 HZ1 LYS A 9 6.567 -4.614 -4.807 0.00 0.00 +0.118 HD ATOM 102 HZ2 LYS A 9 7.446 -4.958 -3.491 0.00 0.00 +0.118 HD ENDBRANCH 99 100 ENDBRANCH 98 99 ENDBRANCH 97 98 ENDBRANCH 96 97 ENDBRANCH 6 96 ENDBRANCH 4 6 ENDBRANCH 1 2 BRANCH 1 105 ATOM 103 N THR A 11 9.264 -1.056 2.723 0.00 0.00 -0.300 N ATOM 104 H THR A 11 10.236 -1.077 3.013 0.00 0.00 +0.150 HD ATOM 105 C SER A 10 8.940 -2.248 2.146 0.00 0.00 +0.236 C ATOM 106 O SER A 10 9.743 -3.173 2.303 0.00 0.00 -0.274 OA BRANCH 103 107 ATOM 107 CA THR A 11 8.668 0.271 2.539 0.00 0.00 +0.187 C BRANCH 107 110 ATOM 108 N GLY A 12 9.012 2.295 1.146 0.00 0.00 -0.305 N ATOM 109 H GLY A 12 8.581 2.772 1.942 0.00 0.00 +0.149 HD ATOM 110 C THR A 11 9.330 0.964 1.319 0.00 0.00 +0.236 C ATOM 111 O THR A 11 10.010 0.342 0.506 0.00 0.00 -0.274 OA BRANCH 108 112 ATOM 112 CA GLY A 12 9.676 3.102 0.133 0.00 0.00 +0.200 C BRANCH 112 115 ATOM 113 N GLY A 13 7.976 2.703 -1.687 0.00 0.00 -0.305 N ATOM 114 H GLY A 13 7.876 2.291 -2.607 0.00 0.00 +0.149 HD ATOM 115 C GLY A 12 9.290 2.801 -1.324 0.00 0.00 +0.231 C ATOM 116 O GLY A 12 10.142 2.789 -2.216 0.00 0.00 -0.274 OA BRANCH 113 117 ATOM 117 CA GLY A 13 6.834 2.670 -0.791 0.00 0.00 +0.200 C BRANCH 117 120 ATOM 118 N LYS A 14 5.367 2.916 -2.761 0.00 0.00 -0.303 N ATOM 119 H LYS A 14 6.186 3.239 -3.267 0.00 0.00 +0.149 HD ATOM 120 C GLY A 13 5.480 2.477 -1.467 0.00 0.00 +0.231 C ATOM 121 O GLY A 13 4.518 2.035 -0.833 0.00 0.00 -0.274 OA BRANCH 118 122 ATOM 122 CA LYS A 14 4.189 2.585 -3.554 0.00 0.00 +0.159 C BRANCH 122 125 ATOM 123 N ALA A 15 3.747 1.714 -5.792 0.00 0.00 -0.303 N ATOM 124 H ALA A 15 2.894 1.340 -5.362 0.00 0.00 +0.149 HD ATOM 125 C LYS A 14 4.585 2.495 -5.035 0.00 0.00 +0.234 C ATOM 126 O LYS A 14 5.577 3.061 -5.487 0.00 0.00 -0.274 OA BRANCH 123 127 ATOM 127 CA ALA A 15 3.917 1.487 -7.226 0.00 0.00 +0.156 C ATOM 128 CB ALA A 15 5.137 0.622 -7.518 0.00 0.00 +0.038 C BRANCH 127 131 ATOM 129 CA PRO A 16 0.229 1.218 -7.556 0.00 0.00 +0.162 C ATOM 130 N PRO A 16 1.575 1.677 -7.941 0.00 0.00 -0.288 N ATOM 131 C ALA A 15 2.632 0.778 -7.671 0.00 0.00 +0.236 C ATOM 132 O ALA A 15 2.474 -0.441 -7.575 0.00 0.00 -0.274 OA ATOM 133 CD PRO A 16 1.492 1.982 -9.354 0.00 0.00 +0.109 C ATOM 134 CG PRO A 16 0.603 0.873 -9.925 0.00 0.00 +0.021 C ATOM 135 CB PRO A 16 -0.200 0.337 -8.727 0.00 0.00 +0.033 C BRANCH 129 138 ATOM 136 N ARG A 17 -0.935 0.076 -5.584 0.00 0.00 -0.302 N ATOM 137 H ARG A 17 -0.791 -0.199 -4.620 0.00 0.00 +0.150 HD ATOM 138 C PRO A 16 0.175 0.688 -6.093 0.00 0.00 +0.234 C ATOM 139 O PRO A 16 1.087 0.902 -5.282 0.00 0.00 -0.274 OA BRANCH 136 140 ATOM 140 CA ARG A 17 -2.313 0.094 -6.085 0.00 0.00 +0.159 C BRANCH 140 143 ATOM 141 N LYS A 18 -2.373 2.265 -4.888 0.00 0.00 -0.302 N ATOM 142 H LYS A 18 -1.435 1.949 -4.669 0.00 0.00 +0.150 HD ATOM 143 C ARG A 17 -3.086 1.378 -5.687 0.00 0.00 +0.234 C ATOM 144 O ARG A 17 -4.264 1.555 -6.000 0.00 0.00 -0.274 OA BRANCH 141 145 ATOM 145 CA LYS A 18 -3.088 2.759 -3.720 0.00 0.00 +0.159 C BRANCH 145 148 ATOM 146 N GLN A 19 -5.303 3.501 -3.067 0.00 0.00 -0.302 N ATOM 147 H GLN A 19 -5.242 2.703 -2.434 0.00 0.00 +0.150 HD ATOM 148 C LYS A 18 -4.289 3.686 -3.986 0.00 0.00 +0.234 C ATOM 149 O LYS A 18 -4.303 4.545 -4.861 0.00 0.00 -0.274 OA BRANCH 146 150 ATOM 150 CA GLN A 19 -6.451 4.396 -2.976 0.00 0.00 +0.159 C BRANCH 150 153 ATOM 151 N LEU A 20 -6.486 3.751 -0.588 0.00 0.00 -0.302 N ATOM 152 H LEU A 20 -6.114 2.830 -0.815 0.00 0.00 +0.150 HD ATOM 153 C GLN A 19 -7.170 4.389 -1.601 0.00 0.00 +0.234 C ATOM 154 O GLN A 19 -8.219 4.997 -1.401 0.00 0.00 -0.274 OA BRANCH 151 155 ATOM 155 CA LEU A 20 -6.824 3.930 0.818 0.00 0.00 +0.159 C BRANCH 155 156 ATOM 156 C LEU A 20 -8.148 3.266 1.248 0.00 0.00 +0.234 C ATOM 157 N ALA A 21 -8.408 2.086 0.568 0.00 0.00 -0.301 N ATOM 158 H ALA A 21 -9.243 2.238 -0.002 0.00 0.00 +0.150 HD ATOM 159 O LEU A 20 -8.771 3.579 2.260 0.00 0.00 -0.274 OA BRANCH 157 160 ATOM 160 CA ALA A 21 -8.618 0.880 1.380 0.00 0.00 +0.179 C ATOM 161 CB ALA A 21 -7.487 0.673 2.392 0.00 0.00 +0.040 C BRANCH 160 162 ATOM 162 C ALA A 21 -10.017 0.849 2.003 0.00 0.00 +0.325 C ATOM 163 O ALA A 21 -11.037 1.291 1.489 0.00 0.00 -0.249 OA BRANCH 162 164 ATOM 164 OXT ALA A 21 -10.094 0.183 3.175 0.00 0.00 -0.479 OA ATOM 165 HXT ALA A 21 -11.029 0.302 3.449 0.00 0.00 +0.295 HD ENDBRANCH 162 164 ENDBRANCH 160 162 ENDBRANCH 157 160 ENDBRANCH 155 156 BRANCH 155 166 ATOM 166 CB LEU A 20 -6.699 5.380 1.319 0.00 0.00 +0.034 C BRANCH 166 168 ATOM 167 CD1 LEU A 20 -4.139 5.268 1.465 0.00 0.00 +0.007 C ATOM 168 CG LEU A 20 -5.357 6.071 0.993 0.00 0.00 -0.015 C ATOM 169 CD2 LEU A 20 -5.330 7.466 1.624 0.00 0.00 +0.007 C ENDBRANCH 166 168 ENDBRANCH 155 166 ENDBRANCH 151 155 ENDBRANCH 150 153 BRANCH 150 170 ATOM 170 CB GLN A 19 -7.421 4.228 -4.153 0.00 0.00 +0.041 C BRANCH 170 171 ATOM 171 CG GLN A 19 -7.994 2.814 -4.277 0.00 0.00 +0.098 C BRANCH 171 172 ATOM 172 CD GLN A 19 -8.275 2.487 -5.726 0.00 0.00 +0.211 C ATOM 173 OE1 GLN A 19 -9.391 2.553 -6.230 0.00 0.00 -0.276 OA ATOM 174 NE2 GLN A 19 -7.192 2.088 -6.449 0.00 0.00 -0.329 N ATOM 175 HE21 GLN A 19 -6.232 2.215 -6.117 0.00 0.00 +0.145 HD ATOM 176 HE22 GLN A 19 -7.299 2.037 -7.455 0.00 0.00 +0.145 HD ENDBRANCH 171 172 ENDBRANCH 170 171 ENDBRANCH 150 170 ENDBRANCH 146 150 ENDBRANCH 145 148 BRANCH 145 177 ATOM 177 CB LYS A 18 -2.149 3.383 -2.672 0.00 0.00 +0.032 C BRANCH 177 178 ATOM 178 CG LYS A 18 -1.609 4.760 -3.045 0.00 0.00 +0.003 C BRANCH 178 179 ATOM 179 CD LYS A 18 -0.715 5.316 -1.929 0.00 0.00 +0.015 C BRANCH 179 180 ATOM 180 CE LYS A 18 -0.391 6.806 -2.091 0.00 0.00 +0.077 C BRANCH 180 181 ATOM 181 NZ LYS A 18 -1.557 7.636 -1.806 0.00 0.00 -0.330 NA ATOM 182 HZ1 LYS A 18 -2.280 7.478 -2.507 0.00 0.00 +0.118 HD ATOM 183 HZ2 LYS A 18 -1.298 8.620 -1.901 0.00 0.00 +0.118 HD ENDBRANCH 180 181 ENDBRANCH 179 180 ENDBRANCH 178 179 ENDBRANCH 177 178 ENDBRANCH 145 177 ENDBRANCH 141 145 ENDBRANCH 140 143 BRANCH 140 184 ATOM 184 CB ARG A 17 -3.071 -1.188 -5.662 0.00 0.00 +0.033 C BRANCH 184 185 ATOM 185 CG ARG A 17 -3.948 -1.136 -4.400 0.00 0.00 +0.023 C BRANCH 185 186 ATOM 186 CD ARG A 17 -3.220 -1.060 -3.058 0.00 0.00 +0.115 C BRANCH 186 187 ATOM 187 NE ARG A 17 -4.115 -0.524 -2.049 0.00 0.00 -0.356 N ATOM 188 HE ARG A 17 -5.116 -0.731 -2.208 0.00 0.00 +0.162 HD BRANCH 187 189 ATOM 189 CZ ARG A 17 -3.863 0.502 -1.214 0.00 0.00 +0.188 C ATOM 190 NH1 ARG A 17 -4.726 1.407 -0.896 0.00 0.00 -0.269 NA ATOM 191 HH1 ARG A 17 -4.236 2.048 -0.259 0.00 0.00 +0.190 HD BRANCH 189 192 ATOM 192 NH2 ARG A 17 -2.592 0.583 -0.771 0.00 0.00 -0.370 N ATOM 193 HH21 ARG A 17 -2.160 -0.342 -0.689 0.00 0.00 +0.159 HD ATOM 194 HH22 ARG A 17 -2.472 1.058 0.110 0.00 0.00 +0.159 HD ENDBRANCH 189 192 ENDBRANCH 187 189 ENDBRANCH 186 187 ENDBRANCH 185 186 ENDBRANCH 184 185 ENDBRANCH 140 184 ENDBRANCH 136 140 ENDBRANCH 129 138 ENDBRANCH 127 131 ENDBRANCH 123 127 ENDBRANCH 122 125 BRANCH 122 195 ATOM 195 CB LYS A 14 2.993 3.515 -3.287 0.00 0.00 +0.032 C BRANCH 195 196 ATOM 196 CG LYS A 14 3.226 5.010 -3.531 0.00 0.00 +0.003 C BRANCH 196 197 ATOM 197 CD LYS A 14 3.103 5.492 -4.981 0.00 0.00 +0.015 C BRANCH 197 198 ATOM 198 CE LYS A 14 1.727 5.230 -5.600 0.00 0.00 +0.077 C BRANCH 198 199 ATOM 199 NZ LYS A 14 1.629 5.860 -6.912 0.00 0.00 -0.330 NA ATOM 200 HZ1 LYS A 14 2.337 5.481 -7.537 0.00 0.00 +0.118 HD ATOM 201 HZ2 LYS A 14 0.720 5.650 -7.323 0.00 0.00 +0.118 HD ENDBRANCH 198 199 ENDBRANCH 197 198 ENDBRANCH 196 197 ENDBRANCH 195 196 ENDBRANCH 122 195 ENDBRANCH 118 122 ENDBRANCH 117 120 ENDBRANCH 113 117 ENDBRANCH 112 115 ENDBRANCH 108 112 ENDBRANCH 107 110 BRANCH 107 202 ATOM 202 CB THR A 11 8.798 1.104 3.836 0.00 0.00 +0.141 C ATOM 203 CG2 THR A 11 10.233 1.460 4.220 0.00 0.00 +0.040 C BRANCH 202 204 ATOM 204 OG1 THR A 11 8.053 2.325 3.724 0.00 0.00 -0.390 OA ATOM 205 HG1 THR A 11 8.031 2.716 4.618 0.00 0.00 +0.210 HD ENDBRANCH 202 204 ENDBRANCH 107 202 ENDBRANCH 103 107 ENDBRANCH 1 105 BRANCH 1 206 ATOM 206 CB SER A 10 7.533 -3.922 0.941 0.00 0.00 +0.187 C BRANCH 206 207 ATOM 207 OG SER A 10 6.208 -4.324 0.582 0.00 0.00 -0.393 OA ATOM 208 H SER A 10 6.297 -5.195 0.159 0.00 0.00 +0.209 HD ENDBRANCH 206 207 ENDBRANCH 1 206 TORSDOF 96