D00TCL AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNK A 0 13.329 2.347 6.316 1.00 0.00 C HETATM 2 C UNK A 0 13.449 2.958 4.905 1.00 0.00 C HETATM 3 C UNK A 0 12.681 2.269 3.759 1.00 0.00 C HETATM 4 C UNK A 0 13.295 1.176 2.844 1.00 0.00 C HETATM 5 C UNK A 0 13.451 -0.315 3.251 1.00 0.00 C HETATM 6 C UNK A 0 12.132 -1.046 3.554 1.00 0.00 C HETATM 7 C UNK A 0 12.149 -2.592 3.622 1.00 0.00 C HETATM 8 C UNK A 0 13.014 -3.264 4.680 1.00 0.00 C HETATM 9 O UNK A 0 13.038 1.162 6.487 1.00 0.00 O HETATM 10 C UNK A 0 13.564 3.297 7.518 1.00 0.00 C ATOM 11 CB GLU A 1 12.810 5.750 9.334 1.00 0.00 C ATOM 12 CA GLU A 1 12.334 4.231 9.476 1.00 0.00 C ATOM 13 C GLU A 1 10.973 3.931 10.340 1.00 0.00 C ATOM 14 N GLU A 1 12.254 3.527 8.179 1.00 0.00 N ATOM 15 O GLU A 1 10.422 4.853 10.951 1.00 0.00 O ATOM 16 CG GLU A 1 12.263 6.619 8.180 1.00 0.00 C ATOM 17 CD GLU A 1 13.106 7.865 7.916 1.00 0.00 C ATOM 18 OE2 GLU A 1 14.102 7.874 7.209 1.00 0.00 O ATOM 19 OE1 GLU A 1 12.664 8.989 8.527 1.00 0.00 O ATOM 20 CB THR A 2 10.350 0.417 9.423 1.00 0.00 C ATOM 21 CA THR A 2 9.495 1.640 10.056 1.00 0.00 C ATOM 22 C THR A 2 8.090 1.443 11.098 1.00 0.00 C ATOM 23 N THR A 2 10.617 2.607 10.699 1.00 0.00 N ATOM 24 O THR A 2 8.303 1.433 12.318 1.00 0.00 O ATOM 25 OG1 THR A 2 10.347 0.605 7.989 1.00 0.00 O ATOM 26 CG2 THR A 2 10.138 -1.089 9.644 1.00 0.00 C ATOM 27 HA THR A 2 9.110 2.234 9.223 1.00 0.00 H ATOM 28 CB ALA A 3 5.277 2.281 12.630 1.00 0.00 C ATOM 29 CA ALA A 3 5.235 1.376 11.395 1.00 0.00 C ATOM 30 C ALA A 3 3.613 1.680 10.672 1.00 0.00 C ATOM 31 N ALA A 3 6.725 1.404 10.588 1.00 0.00 N ATOM 32 O ALA A 3 3.481 1.731 9.447 1.00 0.00 O ATOM 33 CB SER A 4 0.444 0.596 10.304 1.00 0.00 C ATOM 34 CA SER A 4 0.780 1.839 11.219 1.00 0.00 C ATOM 35 C SER A 4 -0.724 2.823 11.120 1.00 0.00 C ATOM 36 N SER A 4 2.437 1.819 11.517 1.00 0.00 N ATOM 37 O SER A 4 -1.773 2.161 10.986 1.00 0.00 O ATOM 38 OG SER A 4 0.471 0.930 8.919 1.00 0.00 O ATOM 39 CB ILE A 5 -2.422 6.033 12.574 1.00 0.00 C ATOM 40 CA ILE A 5 -2.377 4.928 11.390 1.00 0.00 C ATOM 41 C ILE A 5 -3.454 5.609 10.225 1.00 0.00 C ATOM 42 N ILE A 5 -0.913 4.210 11.247 1.00 0.00 N ATOM 43 O ILE A 5 -4.453 6.250 10.594 1.00 0.00 O ATOM 44 CG2 ILE A 5 -1.788 5.632 13.908 1.00 0.00 C ATOM 45 CG1 ILE A 5 -1.932 7.430 12.107 1.00 0.00 C ATOM 46 CD1 ILE A 5 -2.156 8.563 13.115 1.00 0.00 C ATOM 47 HA ILE A 5 -2.992 4.100 11.778 1.00 0.00 H ATOM 48 C PRO A 6 -5.197 6.933 6.895 1.00 0.00 C ATOM 49 N PRO A 6 -3.282 5.442 8.852 1.00 0.00 N ATOM 50 CA PRO A 6 -4.264 5.869 7.739 1.00 0.00 C ATOM 51 CB PRO A 6 -4.698 4.462 7.264 1.00 0.00 C ATOM 52 CG PRO A 6 -3.331 3.814 7.119 1.00 0.00 C ATOM 53 CD PRO A 6 -2.674 4.176 8.447 1.00 0.00 C ATOM 54 O PRO A 6 -5.929 6.554 5.970 1.00 0.00 O ATOM 55 C PRO A 7 -5.583 9.253 4.216 1.00 0.00 C ATOM 56 N PRO A 7 -4.942 8.281 6.956 1.00 0.00 N ATOM 57 CA PRO A 7 -5.487 9.270 5.935 1.00 0.00 C ATOM 58 CB PRO A 7 -4.825 10.556 6.570 1.00 0.00 C ATOM 59 CG PRO A 7 -5.177 10.375 8.060 1.00 0.00 C ATOM 60 CD PRO A 7 -4.848 8.901 8.285 1.00 0.00 C ATOM 61 O PRO A 7 -5.370 10.305 3.585 1.00 0.00 O ATOM 62 CB GLN A 8 -5.812 8.255 0.845 1.00 0.00 C ATOM 63 CA GLN A 8 -6.849 8.101 2.038 1.00 0.00 C ATOM 64 C GLN A 8 -7.975 6.897 1.796 1.00 0.00 C ATOM 65 N GLN A 8 -6.164 8.141 3.512 1.00 0.00 N ATOM 66 O GLN A 8 -8.000 5.935 2.567 1.00 0.00 O ATOM 67 CG GLN A 8 -6.057 7.859 -0.657 1.00 0.00 C ATOM 68 CD GLN A 8 -7.175 8.513 -1.437 1.00 0.00 C ATOM 69 OE1 GLN A 8 -8.181 9.001 -0.918 1.00 0.00 O ATOM 70 NE2 GLN A 8 -7.098 8.446 -2.802 1.00 0.00 N ATOM 71 CB LYS A 9 -11.291 6.926 1.288 1.00 0.00 C ATOM 72 CA LYS A 9 -10.076 6.309 0.433 1.00 0.00 C ATOM 73 C LYS A 9 -10.420 5.869 -1.152 1.00 0.00 C ATOM 74 N LYS A 9 -8.770 7.075 0.685 1.00 0.00 N ATOM 75 O LYS A 9 -11.581 5.771 -1.563 1.00 0.00 O ATOM 76 CG LYS A 9 -11.457 8.477 1.425 1.00 0.00 C ATOM 77 CD LYS A 9 -12.430 8.898 2.577 1.00 0.00 C ATOM 78 CE LYS A 9 -12.576 10.426 2.752 1.00 0.00 C ATOM 79 NZ LYS A 9 -13.483 10.786 3.847 1.00 0.00 N ATOM 80 CB TYR A 10 -8.592 4.537 -4.508 1.00 0.00 C ATOM 81 CA TYR A 10 -9.531 4.457 -3.189 1.00 0.00 C ATOM 82 C TYR A 10 -9.838 3.022 -2.777 1.00 0.00 C ATOM 83 N TYR A 10 -9.345 5.325 -1.936 1.00 0.00 N ATOM 84 O TYR A 10 -9.307 2.023 -3.251 1.00 0.00 O ATOM 85 CG TYR A 10 -7.213 4.050 -5.014 1.00 0.00 C ATOM 86 CD1 TYR A 10 -6.194 3.379 -4.322 1.00 0.00 C ATOM 87 CE1 TYR A 10 -4.904 3.257 -4.891 1.00 0.00 C ATOM 88 CZ TYR A 10 -4.680 3.613 -6.215 1.00 0.00 C ATOM 89 CE2 TYR A 10 -5.799 3.833 -7.002 1.00 0.00 C ATOM 90 CD2 TYR A 10 -6.958 4.266 -6.394 1.00 0.00 C ATOM 91 OH TYR A 10 -3.419 3.841 -6.695 1.00 0.00 O HETATM 92 H UNK A 0 12.977 3.946 5.020 1.00 0.00 H HETATM 93 H UNK A 0 14.495 3.141 4.670 1.00 0.00 H HETATM 94 H UNK A 0 11.682 1.970 4.088 1.00 0.00 H HETATM 95 H UNK A 0 12.516 3.102 3.053 1.00 0.00 H HETATM 96 H UNK A 0 12.638 1.159 1.959 1.00 0.00 H HETATM 97 H UNK A 0 14.260 1.534 2.463 1.00 0.00 H HETATM 98 H UNK A 0 13.906 -0.819 2.383 1.00 0.00 H HETATM 99 H UNK A 0 14.163 -0.417 4.074 1.00 0.00 H HETATM 100 H UNK A 0 11.709 -0.650 4.481 1.00 0.00 H HETATM 101 H UNK A 0 11.424 -0.801 2.751 1.00 0.00 H HETATM 102 H UNK A 0 11.115 -2.910 3.815 1.00 0.00 H HETATM 103 H UNK A 0 12.410 -3.012 2.643 1.00 0.00 H HETATM 104 H UNK A 0 12.825 -2.863 5.680 1.00 0.00 H HETATM 105 H UNK A 0 14.080 -3.182 4.452 1.00 0.00 H HETATM 106 H UNK A 0 12.774 -4.337 4.713 1.00 0.00 H HETATM 107 H UNK A 0 14.268 2.803 8.198 1.00 0.00 H HETATM 108 H UNK A 0 14.026 4.229 7.183 1.00 0.00 H ATOM 109 HB1 GLU A 1 12.644 6.294 10.275 1.00 0.00 H ATOM 110 HB2 GLU A 1 13.907 5.742 9.214 1.00 0.00 H ATOM 111 HA GLU A 1 13.122 3.766 10.091 1.00 0.00 H ATOM 112 H GLU A 1 11.851 2.603 8.365 1.00 0.00 H ATOM 113 HG1 GLU A 1 12.276 6.072 7.232 1.00 0.00 H ATOM 114 HG2 GLU A 1 11.227 6.920 8.355 1.00 0.00 H ATOM 115 HE1 GLU A 1 11.851 8.879 9.053 1.00 0.00 H ATOM 116 HB THR A 2 11.404 0.572 9.706 1.00 0.00 H ATOM 117 H THR A 2 10.308 2.685 11.665 1.00 0.00 H ATOM 118 HG1 THR A 2 11.141 0.167 7.613 1.00 0.00 H ATOM 119 HG21 THR A 2 9.100 -1.406 9.541 1.00 0.00 H ATOM 120 HG22 THR A 2 10.548 -1.452 10.594 1.00 0.00 H ATOM 121 HG23 THR A 2 10.688 -1.655 8.866 1.00 0.00 H ATOM 122 HB1 ALA A 3 4.725 1.809 13.454 1.00 0.00 H ATOM 123 HB2 ALA A 3 4.775 3.230 12.420 1.00 0.00 H ATOM 124 HB3 ALA A 3 6.278 2.505 12.994 1.00 0.00 H ATOM 125 HA ALA A 3 5.190 0.329 11.735 1.00 0.00 H ATOM 126 H ALA A 3 6.660 0.959 9.680 1.00 0.00 H ATOM 127 HB1 SER A 4 1.127 -0.243 10.479 1.00 0.00 H ATOM 128 HB2 SER A 4 -0.561 0.201 10.511 1.00 0.00 H ATOM 129 HA SER A 4 0.532 1.445 12.226 1.00 0.00 H ATOM 130 H SER A 4 2.603 1.420 12.436 1.00 0.00 H ATOM 131 H SER A 4 1.200 1.561 8.777 1.00 0.00 H ATOM 132 HB ILE A 5 -3.489 6.167 12.819 1.00 0.00 H ATOM 133 H ILE A 5 -0.119 4.787 11.458 1.00 0.00 H ATOM 134 HG21 ILE A 5 -0.713 5.469 13.820 1.00 0.00 H ATOM 135 HG22 ILE A 5 -2.262 4.736 14.320 1.00 0.00 H ATOM 136 HG23 ILE A 5 -1.938 6.421 14.660 1.00 0.00 H ATOM 137 HG11 ILE A 5 -0.872 7.385 11.843 1.00 0.00 H ATOM 138 HG12 ILE A 5 -2.471 7.724 11.201 1.00 0.00 H ATOM 139 HD11 ILE A 5 -1.391 8.559 13.897 1.00 0.00 H ATOM 140 HD12 ILE A 5 -3.141 8.504 13.591 1.00 0.00 H ATOM 141 HD13 ILE A 5 -2.095 9.534 12.609 1.00 0.00 H ATOM 142 HA PRO A 6 -3.419 6.181 7.094 1.00 0.00 H ATOM 143 HB1 PRO A 6 -5.295 3.964 8.040 1.00 0.00 H ATOM 144 HB2 PRO A 6 -5.267 4.418 6.333 1.00 0.00 H ATOM 145 HG1 PRO A 6 -3.373 2.743 6.921 1.00 0.00 H ATOM 146 HG2 PRO A 6 -2.796 4.291 6.285 1.00 0.00 H ATOM 147 HD1 PRO A 6 -1.594 4.309 8.363 1.00 0.00 H ATOM 148 HD2 PRO A 6 -2.912 3.402 9.180 1.00 0.00 H ATOM 149 HA PRO A 7 -6.559 9.350 6.176 1.00 0.00 H ATOM 150 HB1 PRO A 7 -5.165 11.520 6.186 1.00 0.00 H ATOM 151 HB2 PRO A 7 -3.726 10.531 6.493 1.00 0.00 H ATOM 152 HG1 PRO A 7 -4.652 11.035 8.762 1.00 0.00 H ATOM 153 HG2 PRO A 7 -6.253 10.554 8.203 1.00 0.00 H ATOM 154 HD1 PRO A 7 -5.565 8.443 8.980 1.00 0.00 H ATOM 155 HD2 PRO A 7 -3.838 8.763 8.683 1.00 0.00 H ATOM 156 HB1 GLN A 8 -4.900 7.717 1.131 1.00 0.00 H ATOM 157 HB2 GLN A 8 -5.536 9.316 0.820 1.00 0.00 H ATOM 158 HA GLN A 8 -7.457 9.014 2.027 1.00 0.00 H ATOM 159 H GLN A 8 -6.292 7.310 4.086 1.00 0.00 H ATOM 160 HG1 GLN A 8 -5.143 8.134 -1.209 1.00 0.00 H ATOM 161 HG2 GLN A 8 -6.155 6.772 -0.773 1.00 0.00 H ATOM 162 HE21 GLN A 8 -7.852 8.873 -3.334 1.00 0.00 H ATOM 163 HE22 GLN A 8 -6.271 8.171 -3.323 1.00 0.00 H ATOM 164 HB1 LYS A 9 -12.251 6.508 0.956 1.00 0.00 H ATOM 165 HB2 LYS A 9 -11.152 6.559 2.316 1.00 0.00 H ATOM 166 HA LYS A 9 -9.941 5.312 0.887 1.00 0.00 H ATOM 167 H LYS A 9 -8.785 7.970 0.231 1.00 0.00 H ATOM 168 HG1 LYS A 9 -10.487 8.940 1.631 1.00 0.00 H ATOM 169 HG2 LYS A 9 -11.830 8.891 0.482 1.00 0.00 H ATOM 170 HD1 LYS A 9 -13.424 8.469 2.398 1.00 0.00 H ATOM 171 HD2 LYS A 9 -12.069 8.481 3.526 1.00 0.00 H ATOM 172 HE1 LYS A 9 -11.603 10.884 2.961 1.00 0.00 H ATOM 173 HE2 LYS A 9 -12.960 10.884 1.834 1.00 0.00 H ATOM 174 HZ1 LYS A 9 -13.156 10.383 4.724 1.00 0.00 H ATOM 175 HZ2 LYS A 9 -14.410 10.396 3.683 1.00 0.00 H ATOM 176 HB1 TYR A 10 -9.240 4.047 -5.259 1.00 0.00 H ATOM 177 HB2 TYR A 10 -8.583 5.603 -4.768 1.00 0.00 H ATOM 178 HA TYR A 10 -10.499 4.799 -3.592 1.00 0.00 H ATOM 179 H TYR A 10 -10.678 2.916 -2.066 1.00 0.00 H ATOM 180 H TYR A 10 -8.489 5.191 -1.420 1.00 0.00 H ATOM 181 HD1 TYR A 10 -6.352 2.955 -3.338 1.00 0.00 H ATOM 182 HE1 TYR A 10 -4.063 2.865 -4.325 1.00 0.00 H ATOM 183 HE2 TYR A 10 -5.801 3.376 -8.002 1.00 0.00 H ATOM 184 HD2 TYR A 10 -7.695 4.727 -7.038 1.00 0.00 H ATOM 185 HH TYR A 10 -3.460 4.723 -7.126 1.00 0.00 H CONECT 1 2 9 10 CONECT 2 3 1 92 93 CONECT 3 4 2 94 95 CONECT 4 5 3 96 97 CONECT 5 6 4 98 99 CONECT 6 7 5 100 101 CONECT 7 8 6 102 103 CONECT 8 7 104 105 106 CONECT 9 1 CONECT 10 14 1 107 108 CONECT 11 16 12 109 110 CONECT 12 11 14 13 111 CONECT 13 23 15 12 CONECT 14 10 12 112 CONECT 15 13 CONECT 16 17 11 113 114 CONECT 17 19 18 16 CONECT 18 17 CONECT 19 17 115 CONECT 20 26 21 25 116 CONECT 21 23 20 22 27 CONECT 22 31 24 21 CONECT 23 21 13 117 CONECT 24 22 CONECT 25 20 118 CONECT 26 20 119 120 121 CONECT 27 21 CONECT 28 29 122 123 124 CONECT 29 28 30 31 125 CONECT 30 36 32 29 CONECT 31 22 29 126 CONECT 32 30 CONECT 33 38 34 127 128 CONECT 34 35 36 33 129 CONECT 35 42 37 34 CONECT 36 34 30 130 CONECT 37 35 CONECT 38 33 131 CONECT 39 44 40 45 132 CONECT 40 41 42 47 39 CONECT 41 43 49 40 CONECT 42 40 35 133 CONECT 43 41 CONECT 44 39 134 135 136 CONECT 45 46 39 137 138 CONECT 46 45 139 140 141 CONECT 47 40 CONECT 48 54 56 50 CONECT 49 50 53 41 CONECT 50 51 49 48 142 CONECT 51 52 50 143 144 CONECT 52 53 51 145 146 CONECT 53 52 49 147 148 CONECT 54 48 CONECT 55 61 65 57 CONECT 56 57 60 48 CONECT 57 58 56 55 149 CONECT 58 59 57 150 151 CONECT 59 60 58 152 153 CONECT 60 59 56 154 155 CONECT 61 55 CONECT 62 63 67 156 157 CONECT 63 62 65 64 158 CONECT 64 74 66 63 CONECT 65 55 63 159 CONECT 66 64 CONECT 67 68 62 160 161 CONECT 68 69 70 67 CONECT 69 68 CONECT 70 68 162 163 CONECT 71 76 72 164 165 CONECT 72 71 74 73 166 CONECT 73 83 75 72 CONECT 74 64 72 167 CONECT 75 73 CONECT 76 77 71 168 169 CONECT 77 78 76 170 171 CONECT 78 79 77 172 173 CONECT 79 78 174 175 CONECT 80 85 81 176 177 CONECT 81 80 82 83 178 CONECT 82 84 81 179 CONECT 83 73 81 180 CONECT 84 82 CONECT 85 86 90 80 CONECT 86 87 85 181 CONECT 87 88 86 182 CONECT 88 89 91 87 CONECT 89 90 88 183 CONECT 90 89 85 184 CONECT 91 88 185 CONECT 92 2 CONECT 93 2 CONECT 94 3 CONECT 95 3 CONECT 96 4 CONECT 97 4 CONECT 98 5 CONECT 99 5 CONECT 100 6 CONECT 101 6 CONECT 102 7 CONECT 103 7 CONECT 104 8 CONECT 105 8 CONECT 106 8 CONECT 107 10 CONECT 108 10 CONECT 109 11 CONECT 110 11 CONECT 111 12 CONECT 112 14 CONECT 113 16 CONECT 114 16 CONECT 115 19 CONECT 116 20 CONECT 117 23 CONECT 118 25 CONECT 119 26 CONECT 120 26 CONECT 121 26 CONECT 122 28 CONECT 123 28 CONECT 124 28 CONECT 125 29 CONECT 126 31 CONECT 127 33 CONECT 128 33 CONECT 129 34 CONECT 130 36 CONECT 131 38 CONECT 132 39 CONECT 133 42 CONECT 134 44 CONECT 135 44 CONECT 136 44 CONECT 137 45 CONECT 138 45 CONECT 139 46 CONECT 140 46 CONECT 141 46 CONECT 142 50 CONECT 143 51 CONECT 144 51 CONECT 145 52 CONECT 146 52 CONECT 147 53 CONECT 148 53 CONECT 149 57 CONECT 150 58 CONECT 151 58 CONECT 152 59 CONECT 153 59 CONECT 154 60 CONECT 155 60 CONECT 156 62 CONECT 157 62 CONECT 158 63 CONECT 159 65 CONECT 160 67 CONECT 161 67 CONECT 162 70 CONECT 163 70 CONECT 164 71 CONECT 165 71 CONECT 166 72 CONECT 167 74 CONECT 168 76 CONECT 169 76 CONECT 170 77 CONECT 171 77 CONECT 172 78 CONECT 173 78 CONECT 174 79 CONECT 175 79 CONECT 176 80 CONECT 177 80 CONECT 178 81 CONECT 179 82 CONECT 180 83 CONECT 181 86 CONECT 182 87 CONECT 183 89 CONECT 184 90 CONECT 185 91 MASTER 0 0 0 0 0 0 0 0 185 0 185 0 END M END $$$$