HEADER PROTEIN 04-DEC-19 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-DEC-19 0 HETATM 1 H UNK 0 -0.092 -2.520 0.000 0.00 0.00 H+0 HETATM 2 O UNK 0 0.652 -3.869 0.000 0.00 0.00 O+0 HETATM 3 C UNK 0 2.192 -3.898 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 2.988 -2.580 0.000 0.00 0.00 C+0 HETATM 5 H UNK 0 1.669 -1.784 0.000 0.00 0.00 H+0 HETATM 6 C UNK 0 4.527 -2.610 0.000 0.00 0.00 C+0 HETATM 7 H UNK 0 3.732 -3.928 0.000 0.00 0.00 H+0 HETATM 8 C UNK 0 5.271 -3.958 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 4.476 -5.276 0.000 0.00 0.00 C+0 HETATM 10 H UNK 0 5.220 -6.625 0.000 0.00 0.00 H+0 HETATM 11 C UNK 0 2.936 -5.247 0.000 0.00 0.00 C+0 HETATM 12 H UNK 0 2.140 -6.565 0.000 0.00 0.00 H+0 HETATM 13 C UNK 0 6.811 -3.988 0.000 0.00 0.00 C+0 HETATM 14 H UNK 0 5.612 -4.955 0.000 0.00 0.00 H+0 HETATM 15 H UNK 0 6.514 -5.499 0.000 0.00 0.00 H+0 HETATM 16 C UNK 0 7.607 -2.669 0.000 0.00 0.00 C+0 HETATM 17 H UNK 0 8.402 -1.351 0.000 0.00 0.00 H+0 HETATM 18 N UNK 0 6.067 -2.639 0.000 0.00 0.00 N+0 HETATM 19 H UNK 0 6.863 -1.321 0.000 0.00 0.00 H+0 HETATM 20 C UNK 0 5.323 -1.291 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 3.783 -1.261 0.000 0.00 0.00 O+0 HETATM 22 C UNK 0 6.119 0.028 0.000 0.00 0.00 C+0 HETATM 23 H UNK 0 6.914 1.346 0.000 0.00 0.00 H+0 HETATM 24 N UNK 0 5.374 1.376 0.000 0.00 0.00 N+0 HETATM 25 H UNK 0 4.710 2.765 0.000 0.00 0.00 H+0 HETATM 26 H UNK 0 3.836 1.316 0.000 0.00 0.00 H+0 HETATM 27 C UNK 0 7.658 -0.002 0.000 0.00 0.00 C+0 HETATM 28 H UNK 0 9.095 -0.557 0.000 0.00 0.00 H+0 HETATM 29 H UNK 0 9.115 0.496 0.000 0.00 0.00 H+0 HETATM 30 S UNK 0 8.454 1.316 0.000 0.00 0.00 S+0 HETATM 31 S UNK 0 9.994 1.287 0.000 0.00 0.00 S+0 HETATM 32 C UNK 0 10.789 2.605 0.000 0.00 0.00 C+0 HETATM 33 H UNK 0 11.027 1.084 0.000 0.00 0.00 H+0 HETATM 34 H UNK 0 11.950 1.593 0.000 0.00 0.00 H+0 HETATM 35 C UNK 0 12.329 2.575 0.000 0.00 0.00 C+0 HETATM 36 H UNK 0 13.712 1.898 0.000 0.00 0.00 H+0 HETATM 37 N UNK 0 13.124 3.894 0.000 0.00 0.00 N+0 HETATM 38 H UNK 0 13.920 5.213 0.000 0.00 0.00 H+0 HETATM 39 C UNK 0 14.664 3.864 0.000 0.00 0.00 C+0 HETATM 40 O UNK 0 15.460 5.183 0.000 0.00 0.00 O+0 HETATM 41 C UNK 0 15.408 2.516 0.000 0.00 0.00 C+0 HETATM 42 H UNK 0 16.152 1.168 0.000 0.00 0.00 H+0 HETATM 43 N UNK 0 14.613 1.197 0.000 0.00 0.00 N+0 HETATM 44 H UNK 0 13.442 0.197 0.000 0.00 0.00 H+0 HETATM 45 C UNK 0 15.357 -0.151 0.000 0.00 0.00 C+0 HETATM 46 O UNK 0 16.897 -0.181 0.000 0.00 0.00 O+0 HETATM 47 C UNK 0 14.561 -1.469 0.000 0.00 0.00 C+0 HETATM 48 H UNK 0 13.766 -2.788 0.000 0.00 0.00 H+0 HETATM 49 N UNK 0 13.021 -1.440 0.000 0.00 0.00 N+0 HETATM 50 H UNK 0 11.601 -0.844 0.000 0.00 0.00 H+0 HETATM 51 C UNK 0 12.226 -2.758 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 12.970 -4.107 0.000 0.00 0.00 O+0 HETATM 53 C UNK 0 10.686 -2.729 0.000 0.00 0.00 C+0 HETATM 54 H UNK 0 9.942 -1.380 0.000 0.00 0.00 H+0 HETATM 55 N UNK 0 9.891 -4.047 0.000 0.00 0.00 N+0 HETATM 56 H UNK 0 9.146 -2.699 0.000 0.00 0.00 H+0 HETATM 57 C UNK 0 8.351 -4.017 0.000 0.00 0.00 C+0 HETATM 58 O UNK 0 7.555 -5.336 0.000 0.00 0.00 O+0 HETATM 59 C UNK 0 11.430 -4.077 0.000 0.00 0.00 C+0 HETATM 60 H UNK 0 11.668 -5.598 0.000 0.00 0.00 H+0 HETATM 61 H UNK 0 12.591 -5.089 0.000 0.00 0.00 H+0 HETATM 62 C UNK 0 10.635 -5.395 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 11.379 -6.744 0.000 0.00 0.00 C+0 HETATM 64 H UNK 0 12.800 -7.337 0.000 0.00 0.00 H+0 HETATM 65 C UNK 0 10.583 -8.062 0.000 0.00 0.00 C+0 HETATM 66 H UNK 0 11.327 -9.411 0.000 0.00 0.00 H+0 HETATM 67 C UNK 0 9.043 -8.033 0.000 0.00 0.00 C+0 HETATM 68 H UNK 0 8.248 -9.351 0.000 0.00 0.00 H+0 HETATM 69 C UNK 0 8.299 -6.684 0.000 0.00 0.00 C+0 HETATM 70 H UNK 0 6.951 -7.428 0.000 0.00 0.00 H+0 HETATM 71 C UNK 0 9.095 -5.366 0.000 0.00 0.00 C+0 HETATM 72 H UNK 0 9.839 -6.714 0.000 0.00 0.00 H+0 HETATM 73 C UNK 0 15.305 -2.818 0.000 0.00 0.00 C+0 HETATM 74 H UNK 0 16.668 -3.535 0.000 0.00 0.00 H+0 HETATM 75 H UNK 0 16.695 -2.153 0.000 0.00 0.00 H+0 HETATM 76 C UNK 0 14.510 -4.136 0.000 0.00 0.00 C+0 HETATM 77 H UNK 0 13.714 -5.455 0.000 0.00 0.00 H+0 HETATM 78 H UNK 0 16.049 -4.166 0.000 0.00 0.00 H+0 HETATM 79 C UNK 0 15.254 -5.485 0.000 0.00 0.00 C+0 HETATM 80 O UNK 0 16.793 -5.514 0.000 0.00 0.00 O+0 HETATM 81 N UNK 0 14.458 -6.803 0.000 0.00 0.00 N+0 HETATM 82 H UNK 0 14.826 -8.299 0.000 0.00 0.00 H+0 HETATM 83 H UNK 0 15.829 -7.504 0.000 0.00 0.00 H+0 HETATM 84 C UNK 0 16.948 2.486 0.000 0.00 0.00 C+0 HETATM 85 H UNK 0 17.915 1.288 0.000 0.00 0.00 H+0 HETATM 86 H UNK 0 18.459 2.190 0.000 0.00 0.00 H+0 HETATM 87 C UNK 0 17.744 3.805 0.000 0.00 0.00 C+0 HETATM 88 O UNK 0 17.000 5.153 0.000 0.00 0.00 O+0 HETATM 89 N UNK 0 19.283 3.775 0.000 0.00 0.00 N+0 HETATM 90 H UNK 0 20.822 3.715 0.000 0.00 0.00 H+0 HETATM 91 H UNK 0 19.967 5.155 0.000 0.00 0.00 H+0 HETATM 92 C UNK 0 11.585 3.924 0.000 0.00 0.00 C+0 HETATM 93 O UNK 0 12.380 5.242 0.000 0.00 0.00 O+0 HETATM 94 N UNK 0 10.045 3.953 0.000 0.00 0.00 N+0 HETATM 95 C UNK 0 9.116 2.725 0.000 0.00 0.00 C+0 HETATM 96 H UNK 0 8.668 4.199 0.000 0.00 0.00 H+0 HETATM 97 H UNK 0 7.697 2.127 0.000 0.00 0.00 H+0 HETATM 98 C UNK 0 7.661 3.229 0.000 0.00 0.00 C+0 HETATM 99 H UNK 0 6.213 3.755 0.000 0.00 0.00 H+0 HETATM 100 H UNK 0 6.220 2.685 0.000 0.00 0.00 H+0 HETATM 101 C UNK 0 7.691 4.769 0.000 0.00 0.00 C+0 HETATM 102 H UNK 0 7.590 6.306 0.000 0.00 0.00 H+0 HETATM 103 H UNK 0 6.553 5.807 0.000 0.00 0.00 H+0 HETATM 104 C UNK 0 9.164 5.217 0.000 0.00 0.00 C+0 HETATM 105 H UNK 0 10.690 5.428 0.000 0.00 0.00 H+0 HETATM 106 C UNK 0 9.668 6.672 0.000 0.00 0.00 C+0 HETATM 107 O UNK 0 8.660 7.836 0.000 0.00 0.00 O+0 HETATM 108 N UNK 0 11.180 6.963 0.000 0.00 0.00 N+0 HETATM 109 H UNK 0 12.642 6.476 0.000 0.00 0.00 H+0 HETATM 110 C UNK 0 11.685 8.418 0.000 0.00 0.00 C+0 HETATM 111 H UNK 0 10.172 8.127 0.000 0.00 0.00 H+0 HETATM 112 C UNK 0 10.676 9.582 0.000 0.00 0.00 C+0 HETATM 113 O UNK 0 11.180 11.037 0.000 0.00 0.00 O+0 HETATM 114 N UNK 0 9.164 9.291 0.000 0.00 0.00 N+0 HETATM 115 H UNK 0 9.668 10.746 0.000 0.00 0.00 H+0 HETATM 116 C UNK 0 8.156 10.455 0.000 0.00 0.00 C+0 HETATM 117 H UNK 0 8.400 11.976 0.000 0.00 0.00 H+0 HETATM 118 H UNK 0 7.365 11.777 0.000 0.00 0.00 H+0 HETATM 119 C UNK 0 6.644 10.164 0.000 0.00 0.00 C+0 HETATM 120 O UNK 0 6.140 8.709 0.000 0.00 0.00 O+0 HETATM 121 N UNK 0 5.636 11.328 0.000 0.00 0.00 N+0 HETATM 122 H UNK 0 4.650 12.512 0.000 0.00 0.00 H+0 HETATM 123 H UNK 0 4.153 10.913 0.000 0.00 0.00 H+0 HETATM 124 C UNK 0 13.197 8.709 0.000 0.00 0.00 C+0 HETATM 125 H UNK 0 13.575 7.216 0.000 0.00 0.00 H+0 HETATM 126 H UNK 0 14.620 8.121 0.000 0.00 0.00 H+0 HETATM 127 C UNK 0 13.701 10.164 0.000 0.00 0.00 C+0 HETATM 128 H UNK 0 13.322 11.657 0.000 0.00 0.00 H+0 HETATM 129 H UNK 0 12.277 10.752 0.000 0.00 0.00 H+0 HETATM 130 C UNK 0 15.213 10.455 0.000 0.00 0.00 C+0 HETATM 131 H UNK 0 15.592 8.962 0.000 0.00 0.00 H+0 HETATM 132 H UNK 0 16.636 9.867 0.000 0.00 0.00 H+0 HETATM 133 N UNK 0 15.717 11.910 0.000 0.00 0.00 N+0 HETATM 134 C UNK 0 17.229 12.201 0.000 0.00 0.00 C+0 HETATM 135 N UNK 0 17.734 13.657 0.000 0.00 0.00 N+0 HETATM 136 H UNK 0 19.246 13.948 0.000 0.00 0.00 H+0 HETATM 137 H UNK 0 16.725 14.821 0.000 0.00 0.00 H+0 HETATM 138 N UNK 0 18.238 11.037 0.000 0.00 0.00 N+0 HETATM 139 H UNK 0 17.734 9.582 0.000 0.00 0.00 H+0 HETATM 140 H UNK 0 19.750 11.328 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 11 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 8 CONECT 7 6 CONECT 8 6 9 13 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 3 12 CONECT 12 11 CONECT 13 8 14 15 16 CONECT 14 13 CONECT 15 13 CONECT 16 13 17 18 57 CONECT 17 16 CONECT 18 16 19 20 CONECT 19 18 CONECT 20 18 21 22 CONECT 21 20 CONECT 22 20 23 24 27 CONECT 23 22 CONECT 24 22 25 26 CONECT 25 24 CONECT 26 24 CONECT 27 22 28 29 30 CONECT 28 27 CONECT 29 27 CONECT 30 27 31 CONECT 31 30 32 CONECT 32 31 33 34 35 CONECT 33 32 CONECT 34 32 CONECT 35 32 36 37 92 CONECT 36 35 CONECT 37 35 38 39 CONECT 38 37 CONECT 39 37 40 41 CONECT 40 39 CONECT 41 39 42 43 84 CONECT 42 41 CONECT 43 41 44 45 CONECT 44 43 CONECT 45 43 46 47 CONECT 46 45 CONECT 47 45 48 49 73 CONECT 48 47 CONECT 49 47 50 51 CONECT 50 49 CONECT 51 49 52 53 CONECT 52 51 CONECT 53 51 54 55 59 CONECT 54 53 CONECT 55 53 56 57 CONECT 56 55 CONECT 57 55 16 58 CONECT 58 57 CONECT 59 53 60 61 62 CONECT 60 59 CONECT 61 59 CONECT 62 59 63 71 CONECT 63 62 64 65 CONECT 64 63 CONECT 65 63 66 67 CONECT 66 65 CONECT 67 65 68 69 CONECT 68 67 CONECT 69 67 70 71 CONECT 70 69 CONECT 71 69 62 72 CONECT 72 71 CONECT 73 47 74 75 76 CONECT 74 73 CONECT 75 73 CONECT 76 73 77 78 79 CONECT 77 76 CONECT 78 76 CONECT 79 76 80 81 CONECT 80 79 CONECT 81 79 82 83 CONECT 82 81 CONECT 83 81 CONECT 84 41 85 86 87 CONECT 85 84 CONECT 86 84 CONECT 87 84 88 89 CONECT 88 87 CONECT 89 87 90 91 CONECT 90 89 CONECT 91 89 CONECT 92 35 93 94 CONECT 93 92 CONECT 94 92 95 104 CONECT 95 94 96 97 98 CONECT 96 95 CONECT 97 95 CONECT 98 95 99 100 101 CONECT 99 98 CONECT 100 98 CONECT 101 98 102 103 104 CONECT 102 101 CONECT 103 101 CONECT 104 101 94 105 106 CONECT 105 104 CONECT 106 104 107 108 CONECT 107 106 CONECT 108 106 109 110 CONECT 109 108 CONECT 110 108 111 112 124 CONECT 111 110 CONECT 112 110 113 114 CONECT 113 112 CONECT 114 112 115 116 CONECT 115 114 CONECT 116 114 117 118 119 CONECT 117 116 CONECT 118 116 CONECT 119 116 120 121 CONECT 120 119 CONECT 121 119 122 123 CONECT 122 121 CONECT 123 121 CONECT 124 110 125 126 127 CONECT 125 124 CONECT 126 124 CONECT 127 124 128 129 130 CONECT 128 127 CONECT 129 127 CONECT 130 127 131 132 133 CONECT 131 130 CONECT 132 130 CONECT 133 130 134 CONECT 134 133 135 138 CONECT 135 134 136 137 CONECT 136 135 CONECT 137 135 CONECT 138 134 139 140 CONECT 139 138 CONECT 140 138 MASTER 0 0 0 0 0 0 0 0 140 0 286 0 END