HEADER PROTEIN 24-FEB-12 NONE TITLE NULL COMPND MOLECULE: SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-FEB-12 0 HETATM 1 C UNK 0 21.278 -17.497 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 19.944 -18.267 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 19.944 -19.807 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 21.278 -20.577 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 22.611 -19.807 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 22.611 -18.267 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 23.945 -17.497 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 23.945 -20.577 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 25.279 -19.807 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 25.279 -18.267 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 25.279 -15.187 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 23.945 -15.957 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 26.612 -17.497 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 26.612 -15.957 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 27.946 -15.187 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 27.946 -18.267 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 29.280 -17.497 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 29.280 -15.957 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 29.280 -12.876 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 27.946 -13.646 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 30.613 -15.187 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 30.613 -13.646 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 18.610 -17.497 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 21.278 -19.037 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 18.610 -20.577 0.000 0.00 0.00 O+0 HETATM 26 O UNK 0 21.278 -22.117 0.000 0.00 0.00 O+0 HETATM 27 H UNK 0 22.611 -16.727 0.000 0.00 0.00 H+0 HETATM 28 C UNK 0 25.279 -16.727 0.000 0.00 0.00 C+0 HETATM 29 O UNK 0 23.945 -22.117 0.000 0.00 0.00 O+0 HETATM 30 C UNK 0 22.666 -22.997 0.000 0.00 0.00 C+0 HETATM 31 O UNK 0 24.013 -23.744 0.000 0.00 0.00 O+0 HETATM 32 C UNK 0 21.278 -23.657 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 22.611 -24.427 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 19.944 -24.427 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 17.277 -19.807 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 15.943 -20.577 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 17.277 -18.267 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 14.609 -19.807 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 15.943 -22.117 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 14.609 -18.267 0.000 0.00 0.00 C+0 HETATM 41 H UNK 0 26.612 -14.417 0.000 0.00 0.00 H+0 HETATM 42 C UNK 0 26.612 -19.037 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 27.946 -16.727 0.000 0.00 0.00 C+0 HETATM 44 H UNK 0 29.280 -14.417 0.000 0.00 0.00 H+0 HETATM 45 O UNK 0 31.947 -12.877 0.000 0.00 0.00 O+0 HETATM 46 C UNK 0 33.281 -13.647 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 31.947 -15.957 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 30.613 -16.727 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 34.614 -12.876 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 33.281 -15.187 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 34.614 -15.957 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 35.948 -15.187 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 35.948 -13.647 0.000 0.00 0.00 C+0 HETATM 54 H UNK 0 33.281 -12.107 0.000 0.00 0.00 H+0 HETATM 55 O UNK 0 34.669 -10.402 0.000 0.00 0.00 O+0 HETATM 56 O UNK 0 37.282 -12.877 0.000 0.00 0.00 O+0 HETATM 57 O UNK 0 37.282 -15.957 0.000 0.00 0.00 O+0 HETATM 58 C UNK 0 34.614 -17.497 0.000 0.00 0.00 C+0 HETATM 59 O UNK 0 35.948 -18.267 0.000 0.00 0.00 O+0 HETATM 60 O UNK 0 33.281 -18.267 0.000 0.00 0.00 O+0 HETATM 61 C UNK 0 38.615 -13.647 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 33.336 -9.632 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 32.002 -7.321 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 30.668 -8.091 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 30.668 -9.632 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 32.002 -10.402 0.000 0.00 0.00 C+0 HETATM 67 O UNK 0 33.336 -8.091 0.000 0.00 0.00 O+0 HETATM 68 O UNK 0 32.002 -11.942 0.000 0.00 0.00 O+0 HETATM 69 O UNK 0 29.335 -10.402 0.000 0.00 0.00 O+0 HETATM 70 O UNK 0 29.335 -7.321 0.000 0.00 0.00 O+0 HETATM 71 C UNK 0 32.002 -5.781 0.000 0.00 0.00 C+0 HETATM 72 O UNK 0 30.668 -5.011 0.000 0.00 0.00 O+0 HETATM 73 H UNK 0 34.823 -9.233 0.000 0.00 0.00 H+0 HETATM 74 C UNK 0 39.949 -12.877 0.000 0.00 0.00 C+0 HETATM 75 O UNK 0 38.615 -15.187 0.000 0.00 0.00 O+0 HETATM 76 C UNK 0 39.949 -15.957 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 41.283 -15.187 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 41.283 -13.647 0.000 0.00 0.00 C+0 HETATM 79 H UNK 0 38.615 -12.107 0.000 0.00 0.00 H+0 HETATM 80 O UNK 0 39.949 -11.337 0.000 0.00 0.00 O+0 HETATM 81 O UNK 0 42.616 -12.877 0.000 0.00 0.00 O+0 HETATM 82 O UNK 0 42.616 -15.957 0.000 0.00 0.00 O+0 HETATM 83 C UNK 0 43.373 -9.412 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 44.706 -7.102 0.000 0.00 0.00 C+0 HETATM 85 O UNK 0 43.373 -7.872 0.000 0.00 0.00 O+0 HETATM 86 C UNK 0 44.706 -10.182 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 46.040 -9.412 0.000 0.00 0.00 C+0 HETATM 88 C UNK 0 46.040 -7.872 0.000 0.00 0.00 C+0 HETATM 89 O UNK 0 44.706 -11.722 0.000 0.00 0.00 O+0 HETATM 90 O UNK 0 47.374 -10.182 0.000 0.00 0.00 O+0 HETATM 91 O UNK 0 47.374 -7.102 0.000 0.00 0.00 O+0 HETATM 92 C UNK 0 44.706 -5.562 0.000 0.00 0.00 C+0 HETATM 93 H UNK 0 42.039 -8.642 0.000 0.00 0.00 H+0 CONECT 1 2 6 CONECT 2 1 3 23 24 CONECT 3 2 4 25 CONECT 4 3 5 26 CONECT 5 4 6 8 30 CONECT 6 1 7 5 27 CONECT 7 6 10 12 CONECT 8 5 9 29 CONECT 9 8 10 CONECT 10 9 13 7 28 CONECT 11 12 14 CONECT 12 7 11 CONECT 13 10 14 16 42 CONECT 14 11 15 13 41 CONECT 15 14 18 20 43 CONECT 16 13 17 CONECT 17 16 18 CONECT 18 17 21 15 44 CONECT 19 20 22 CONECT 20 15 19 CONECT 21 18 22 47 48 CONECT 22 21 19 45 CONECT 23 2 CONECT 24 2 CONECT 25 3 35 CONECT 26 4 32 CONECT 27 6 CONECT 28 10 CONECT 29 8 CONECT 30 5 31 CONECT 31 30 CONECT 32 26 33 34 CONECT 33 32 CONECT 34 32 CONECT 35 25 36 37 CONECT 36 35 38 39 CONECT 37 35 CONECT 38 36 40 CONECT 39 36 CONECT 40 38 CONECT 41 14 CONECT 42 13 CONECT 43 15 CONECT 44 18 CONECT 45 22 46 CONECT 46 45 49 50 54 CONECT 47 21 CONECT 48 21 CONECT 49 46 53 55 CONECT 50 46 51 CONECT 51 50 52 58 CONECT 52 51 53 57 CONECT 53 52 49 56 CONECT 54 46 CONECT 55 49 62 CONECT 56 53 61 CONECT 57 52 CONECT 58 51 59 60 CONECT 59 58 CONECT 60 58 CONECT 61 56 74 75 79 CONECT 62 55 66 67 73 CONECT 63 64 67 71 CONECT 64 63 65 70 CONECT 65 64 66 69 CONECT 66 62 65 68 CONECT 67 62 63 CONECT 68 66 CONECT 69 65 CONECT 70 64 CONECT 71 63 72 CONECT 72 71 CONECT 73 62 CONECT 74 61 78 80 CONECT 75 61 76 CONECT 76 75 77 CONECT 77 76 78 82 CONECT 78 77 74 81 CONECT 79 61 CONECT 80 74 83 CONECT 81 78 CONECT 82 77 CONECT 83 80 85 86 93 CONECT 84 85 88 92 CONECT 85 83 84 CONECT 86 83 87 89 CONECT 87 86 88 90 CONECT 88 87 84 91 CONECT 89 86 CONECT 90 87 CONECT 91 88 CONECT 92 84 CONECT 93 83 MASTER 0 0 0 0 0 0 0 0 93 0 202 0 END