HEADER PROTEIN 07-JUN-18 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-JUN-18 0 HETATM 1 C UNK 0 -1.322 3.118 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 1.361 3.118 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 3.111 1.329 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 3.889 0.007 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 3.111 -1.315 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 1.361 -3.104 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.322 -3.104 0.000 0.00 0.00 C+0 HETATM 8 N UNK 0 -1.555 1.601 0.000 0.00 0.00 N+0 HETATM 9 N UNK 0 1.595 1.601 0.000 0.00 0.00 N+0 HETATM 10 N UNK 0 1.595 -1.588 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 -1.555 -1.588 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 2.722 -3.804 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 2.722 -5.344 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 4.056 -6.114 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 4.056 -7.654 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 5.390 -8.424 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 3.850 2.729 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 2.722 5.358 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 4.056 6.128 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 4.056 7.668 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 2.722 3.818 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 0.000 3.896 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 0.000 -3.882 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 3.850 -2.715 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -2.683 -5.344 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -4.016 -6.115 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -4.015 -7.655 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 -5.349 -8.425 0.000 0.00 0.00 O+0 HETATM 29 O UNK 0 -2.681 -8.424 0.000 0.00 0.00 O+0 HETATM 30 C UNK 0 -3.772 -2.715 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -5.312 2.729 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -6.082 4.063 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 -7.622 4.063 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 -2.684 5.358 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 -1.351 6.129 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 -1.351 7.669 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 -0.018 8.439 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 -2.683 3.818 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 -3.772 2.729 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -3.072 1.329 0.000 0.00 0.00 C+0 HETATM 41 O UNK 0 -7.622 -1.382 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 -6.082 -1.382 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -5.312 -2.715 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 -4.017 -4.574 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 -2.683 -3.804 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -4.612 1.329 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 0.000 5.436 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 0.000 -5.422 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 4.620 -4.049 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 5.390 -2.715 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 4.056 4.588 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 -4.542 4.063 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 -3.072 -1.315 0.000 0.00 0.00 C+0 HETATM 54 H UNK 0 -4.612 -1.315 0.000 0.00 0.00 H+0 HETATM 55 C UNK 0 5.390 2.729 0.000 0.00 0.00 C+0 HETATM 56 O UNK 0 8.470 2.729 0.000 0.00 0.00 O+0 HETATM 57 C UNK 0 6.160 1.395 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 7.700 1.395 0.000 0.00 0.00 C+0 HETATM 59 N UNK 0 -5.312 5.397 0.000 0.00 0.00 N+0 HETATM 60 N UNK 0 5.390 5.358 0.000 0.00 0.00 N+0 HETATM 61 Co UNK 0 0.000 0.000 0.000 0.00 0.00 Co+1 HETATM 62 N UNK 0 5.177 18.599 0.000 0.00 0.00 N+0 HETATM 63 C UNK 0 5.653 17.135 0.000 0.00 0.00 C+0 HETATM 64 N UNK 0 7.159 16.814 0.000 0.00 0.00 N+0 HETATM 65 C UNK 0 7.635 15.350 0.000 0.00 0.00 C+0 HETATM 66 N UNK 0 6.604 14.205 0.000 0.00 0.00 N+0 HETATM 67 C UNK 0 5.098 14.525 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 4.622 15.990 0.000 0.00 0.00 C+0 HETATM 69 N UNK 0 3.082 15.990 0.000 0.00 0.00 N+0 HETATM 70 C UNK 0 2.606 14.525 0.000 0.00 0.00 C+0 HETATM 71 N UNK 0 3.852 13.620 0.000 0.00 0.00 N+0 HETATM 72 C UNK 0 3.852 12.080 0.000 0.00 0.00 C+0 HETATM 73 O UNK 0 2.606 11.175 0.000 0.00 0.00 O+0 HETATM 74 C UNK 0 3.082 9.710 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 2.177 8.465 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 4.622 9.710 0.000 0.00 0.00 C+0 HETATM 77 O UNK 0 5.527 8.465 0.000 0.00 0.00 O+0 HETATM 78 C UNK 0 5.098 11.175 0.000 0.00 0.00 C+0 HETATM 79 O UNK 0 6.563 11.651 0.000 0.00 0.00 O+0 HETATM 80 O UNK 0 -2.685 8.438 0.000 0.00 0.00 O+0 HETATM 81 O UNK 0 8.470 0.062 0.000 0.00 0.00 O+0 HETATM 82 O UNK 0 2.722 -8.424 0.000 0.00 0.00 O+0 HETATM 83 O UNK 0 -5.312 -0.048 0.000 0.00 0.00 O+0 CONECT 1 22 8 38 CONECT 2 9 21 22 CONECT 3 4 9 17 CONECT 4 5 3 CONECT 5 10 24 4 CONECT 6 23 12 10 CONECT 7 23 11 45 CONECT 8 1 40 CONECT 9 3 2 CONECT 10 6 5 CONECT 11 7 53 61 CONECT 12 6 24 13 CONECT 13 12 14 CONECT 14 13 15 CONECT 15 14 16 82 CONECT 16 15 CONECT 17 3 21 55 CONECT 18 21 19 CONECT 19 18 20 60 CONECT 20 19 CONECT 21 17 2 18 51 CONECT 22 2 1 47 CONECT 23 6 7 48 CONECT 24 12 5 49 50 CONECT 25 45 26 CONECT 26 25 27 CONECT 27 26 28 29 CONECT 28 27 CONECT 29 27 CONECT 30 53 45 43 CONECT 31 39 32 CONECT 32 31 33 59 CONECT 33 32 CONECT 34 38 35 CONECT 35 34 36 CONECT 36 35 37 80 CONECT 37 36 CONECT 38 1 39 34 CONECT 39 40 38 31 52 CONECT 40 8 39 53 46 CONECT 41 42 CONECT 42 43 83 41 CONECT 43 30 42 CONECT 44 45 CONECT 45 7 30 25 44 CONECT 46 40 CONECT 47 22 CONECT 48 23 CONECT 49 24 CONECT 50 24 CONECT 51 21 CONECT 52 39 CONECT 53 11 30 40 54 CONECT 54 53 CONECT 55 17 57 CONECT 56 58 CONECT 57 55 58 CONECT 58 56 57 81 CONECT 59 32 CONECT 60 19 CONECT 61 11 75 CONECT 62 63 CONECT 63 62 64 68 CONECT 64 63 65 CONECT 65 64 66 CONECT 66 65 67 CONECT 67 66 68 71 CONECT 68 63 67 69 CONECT 69 68 70 CONECT 70 69 71 CONECT 71 67 70 72 CONECT 72 71 73 78 CONECT 73 72 74 CONECT 74 73 75 76 CONECT 75 61 74 CONECT 76 74 77 78 CONECT 77 76 CONECT 78 72 76 79 CONECT 79 78 CONECT 80 36 CONECT 81 58 CONECT 82 15 CONECT 83 42 MASTER 0 0 0 0 0 0 0 0 83 0 180 0 END