HEADER PROTEIN 30-JUN-13 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-JUN-13 0 HETATM 1 C UNK 0 6.442 7.159 0.000 0.00 0.00 C+0 HETATM 2 O UNK 0 6.442 5.619 0.000 0.00 0.00 O+0 HETATM 3 C UNK 0 7.776 4.849 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 9.110 5.619 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 9.110 7.159 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 7.776 7.929 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 5.109 7.929 0.000 0.00 0.00 O+0 HETATM 8 C UNK 0 3.775 7.159 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 2.441 7.929 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 1.107 7.159 0.000 0.00 0.00 C+0 HETATM 11 O UNK 0 1.107 5.619 0.000 0.00 0.00 O+0 HETATM 12 C UNK 0 2.441 4.849 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 3.775 5.619 0.000 0.00 0.00 C+0 HETATM 14 O UNK 0 -0.226 7.929 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 -1.560 7.159 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.894 7.929 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -4.227 7.159 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 -4.227 5.619 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 -2.894 4.849 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -1.560 5.619 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 -5.561 7.929 0.000 0.00 0.00 O+0 HETATM 22 C UNK 0 -6.895 7.159 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -8.228 7.929 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -9.562 7.159 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -6.895 5.619 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 -5.561 4.849 0.000 0.00 0.00 O+0 HETATM 27 C UNK 0 -8.228 4.849 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 -8.228 3.309 0.000 0.00 0.00 O+0 HETATM 29 O UNK 0 -2.894 9.469 0.000 0.00 0.00 O+0 HETATM 30 O UNK 0 7.776 9.469 0.000 0.00 0.00 O+0 HETATM 31 O UNK 0 10.443 7.929 0.000 0.00 0.00 O+0 HETATM 32 O UNK 0 10.443 4.849 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 5.340 4.849 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 5.340 3.230 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 4.006 2.460 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 4.006 0.920 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 5.340 0.150 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 6.673 0.920 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 6.673 2.460 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 8.007 0.150 0.000 0.00 0.00 C+0 HETATM 41 O UNK 0 9.341 0.920 0.000 0.00 0.00 O+0 HETATM 42 O UNK 0 5.340 -1.390 0.000 0.00 0.00 O+0 HETATM 43 O UNK 0 2.672 0.150 0.000 0.00 0.00 O+0 HETATM 44 O UNK 0 2.449 2.286 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 -2.894 3.309 0.000 0.00 0.00 C+0 HETATM 46 O UNK 0 -1.560 2.539 0.000 0.00 0.00 O+0 HETATM 47 C UNK 0 -1.560 0.999 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -2.894 0.229 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -2.894 -1.311 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 -1.560 -2.081 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 -0.226 -1.311 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 -0.226 0.229 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 -4.227 -2.081 0.000 0.00 0.00 O+0 HETATM 54 C UNK 0 -4.227 -3.621 0.000 0.00 0.00 C+0 HETATM 55 O UNK 0 -2.894 -4.391 0.000 0.00 0.00 O+0 HETATM 56 C UNK 0 -2.894 -5.931 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 -4.227 -6.701 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 -5.561 -5.931 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 -5.561 -4.391 0.000 0.00 0.00 C+0 HETATM 60 O UNK 0 -4.227 -8.241 0.000 0.00 0.00 O+0 HETATM 61 O UNK 0 -6.895 -6.701 0.000 0.00 0.00 O+0 HETATM 62 C UNK 0 1.107 -2.081 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 2.441 -1.311 0.000 0.00 0.00 O+0 HETATM 64 O UNK 0 -1.560 -3.621 0.000 0.00 0.00 O+0 HETATM 65 C UNK 0 -0.226 -4.391 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 -0.226 -5.931 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 1.108 -6.701 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 2.441 -5.931 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 2.441 -4.391 0.000 0.00 0.00 C+0 HETATM 70 O UNK 0 1.107 -3.621 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 -1.120 -7.306 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 3.775 -3.621 0.000 0.00 0.00 C+0 HETATM 73 O UNK 0 3.775 -6.701 0.000 0.00 0.00 O+0 HETATM 74 O UNK 0 1.108 -8.241 0.000 0.00 0.00 O+0 HETATM 75 O UNK 0 3.775 -2.081 0.000 0.00 0.00 O+0 HETATM 76 O UNK 0 -8.228 9.469 0.000 0.00 0.00 O+0 HETATM 77 O UNK 0 -9.562 5.619 0.000 0.00 0.00 O+0 HETATM 78 O UNK 0 -6.895 -3.621 0.000 0.00 0.00 O+0 HETATM 79 C UNK 0 2.441 3.309 0.000 0.00 0.00 C+0 HETATM 80 O UNK 0 1.107 2.539 0.000 0.00 0.00 O+0 HETATM 81 O UNK 0 -0.226 4.849 0.000 0.00 0.00 O+0 HETATM 82 N NHAc 1 2.441 9.469 0.000 0.00 0.00 N+0 HETATM 83 O NHAc 1 -0.226 9.469 0.000 0.00 0.00 O+0 HETATM 84 C NHAc 1 1.107 10.239 0.000 0.00 0.00 C+0 HETATM 85 C NHAc 1 1.107 11.779 0.000 0.00 0.00 C+0 HETATM 86 C CHO 2 -10.896 7.929 0.000 0.00 0.00 C+0 HETATM 87 O CHO 2 -10.896 9.469 0.000 0.00 0.00 O+0 HETATM 88 C Me 3 7.773 3.309 0.000 0.00 0.00 C+0 HETATM 89 C Me 4 -1.450 -5.656 0.000 0.00 0.00 C+0 HETATM 90 N NHAc 5 -4.227 0.999 0.000 0.00 0.00 N+0 HETATM 91 O NHAc 5 -5.561 -1.311 0.000 0.00 0.00 O+0 HETATM 92 C NHAc 5 -5.561 0.229 0.000 0.00 0.00 C+0 HETATM 93 C NHAc 5 -6.895 0.999 0.000 0.00 0.00 C+0 CONECT 1 2 6 7 CONECT 2 1 3 CONECT 3 2 4 88 CONECT 4 3 5 32 CONECT 5 4 6 31 CONECT 6 5 1 30 CONECT 7 1 8 CONECT 8 7 9 13 CONECT 9 8 10 82 CONECT 10 9 11 14 CONECT 11 10 12 CONECT 12 11 13 79 CONECT 13 12 8 33 CONECT 14 10 15 CONECT 15 14 16 20 CONECT 16 15 17 29 CONECT 17 16 18 21 CONECT 18 17 19 CONECT 19 18 20 45 CONECT 20 19 15 81 CONECT 21 17 22 CONECT 22 21 23 25 CONECT 23 22 24 76 CONECT 24 23 77 86 CONECT 25 22 26 27 CONECT 26 25 CONECT 27 25 28 CONECT 28 27 CONECT 29 16 CONECT 30 6 CONECT 31 5 CONECT 32 4 CONECT 33 13 34 CONECT 34 33 35 39 CONECT 35 34 36 44 CONECT 36 35 37 43 CONECT 37 36 38 42 CONECT 38 37 39 40 CONECT 39 38 34 CONECT 40 38 41 CONECT 41 40 CONECT 42 37 CONECT 43 36 CONECT 44 35 CONECT 45 19 46 CONECT 46 45 47 CONECT 47 46 48 52 CONECT 48 47 49 90 CONECT 49 48 50 53 CONECT 50 49 51 64 CONECT 51 50 52 62 CONECT 52 51 47 CONECT 53 49 54 CONECT 54 53 55 59 CONECT 55 54 56 CONECT 56 55 57 89 CONECT 57 56 58 60 CONECT 58 57 59 61 CONECT 59 58 54 78 CONECT 60 57 CONECT 61 58 CONECT 62 51 63 CONECT 63 62 CONECT 64 50 65 CONECT 65 64 66 70 CONECT 66 65 67 71 CONECT 67 66 68 74 CONECT 68 67 69 73 CONECT 69 68 70 72 CONECT 70 69 65 CONECT 71 66 CONECT 72 69 75 CONECT 73 68 CONECT 74 67 CONECT 75 72 CONECT 76 23 CONECT 77 24 CONECT 78 59 CONECT 79 12 80 CONECT 80 79 CONECT 81 20 CONECT 82 9 84 CONECT 83 84 CONECT 84 82 83 85 CONECT 85 84 CONECT 86 24 87 CONECT 87 86 CONECT 88 3 CONECT 89 56 CONECT 90 48 92 CONECT 91 92 CONECT 92 90 91 93 CONECT 93 92 MASTER 0 0 0 0 0 0 0 0 93 0 198 0 END