HEADER PROTEIN 30-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-APR-22 0 HETATM 1 H UNK 0 -22.697 8.561 0.000 0.00 0.00 H+0 HETATM 2 O UNK 0 -24.031 7.791 0.000 0.00 0.00 O+0 HETATM 3 C UNK 0 -24.031 6.251 0.000 0.00 0.00 C+0 HETATM 4 H UNK 0 -22.697 7.021 0.000 0.00 0.00 H+0 HETATM 5 C UNK 0 -22.697 5.481 0.000 0.00 0.00 C+0 HETATM 6 O UNK 0 -22.697 3.941 0.000 0.00 0.00 O+0 HETATM 7 N UNK 0 -21.363 6.251 0.000 0.00 0.00 N+0 HETATM 8 H UNK 0 -20.593 7.585 0.000 0.00 0.00 H+0 HETATM 9 C UNK 0 -20.030 5.481 0.000 0.00 0.00 C+0 HETATM 10 H UNK 0 -20.721 4.105 0.000 0.00 0.00 H+0 HETATM 11 H UNK 0 -19.338 4.105 0.000 0.00 0.00 H+0 HETATM 12 C UNK 0 -18.696 6.251 0.000 0.00 0.00 C+0 HETATM 13 H UNK 0 -18.005 7.627 0.000 0.00 0.00 H+0 HETATM 14 H UNK 0 -19.387 7.627 0.000 0.00 0.00 H+0 HETATM 15 C UNK 0 -17.362 5.481 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 -17.362 3.941 0.000 0.00 0.00 O+0 HETATM 17 N UNK 0 -16.029 6.251 0.000 0.00 0.00 N+0 HETATM 18 H UNK 0 -16.029 7.791 0.000 0.00 0.00 H+0 HETATM 19 C UNK 0 -14.695 5.481 0.000 0.00 0.00 C+0 HETATM 20 H UNK 0 -15.386 4.105 0.000 0.00 0.00 H+0 HETATM 21 H UNK 0 -14.004 4.105 0.000 0.00 0.00 H+0 HETATM 22 C UNK 0 -13.361 6.251 0.000 0.00 0.00 C+0 HETATM 23 H UNK 0 -12.670 7.627 0.000 0.00 0.00 H+0 HETATM 24 H UNK 0 -14.052 7.627 0.000 0.00 0.00 H+0 HETATM 25 S UNK 0 -12.028 5.481 0.000 0.00 0.00 S+0 HETATM 26 C UNK 0 -10.694 6.251 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 -10.694 7.791 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 -9.360 5.481 0.000 0.00 0.00 C+0 HETATM 29 H UNK 0 -10.051 4.105 0.000 0.00 0.00 H+0 HETATM 30 H UNK 0 -8.669 4.105 0.000 0.00 0.00 H+0 HETATM 31 C UNK 0 -8.026 6.251 0.000 0.00 0.00 C+0 HETATM 32 H UNK 0 -7.335 7.627 0.000 0.00 0.00 H+0 HETATM 33 H UNK 0 -8.718 7.627 0.000 0.00 0.00 H+0 HETATM 34 C UNK 0 -6.693 5.481 0.000 0.00 0.00 C+0 HETATM 35 H UNK 0 -7.384 4.105 0.000 0.00 0.00 H+0 HETATM 36 H UNK 0 -6.002 4.105 0.000 0.00 0.00 H+0 HETATM 37 C UNK 0 -5.359 6.251 0.000 0.00 0.00 C+0 HETATM 38 H UNK 0 -4.668 7.627 0.000 0.00 0.00 H+0 HETATM 39 H UNK 0 -6.050 7.627 0.000 0.00 0.00 H+0 HETATM 40 C UNK 0 -4.025 5.481 0.000 0.00 0.00 C+0 HETATM 41 H UNK 0 -4.717 4.105 0.000 0.00 0.00 H+0 HETATM 42 H UNK 0 -3.334 4.105 0.000 0.00 0.00 H+0 HETATM 43 C UNK 0 -2.692 6.251 0.000 0.00 0.00 C+0 HETATM 44 H UNK 0 -2.001 7.627 0.000 0.00 0.00 H+0 HETATM 45 H UNK 0 -3.383 7.627 0.000 0.00 0.00 H+0 HETATM 46 C UNK 0 -1.358 5.481 0.000 0.00 0.00 C+0 HETATM 47 H UNK 0 -2.049 4.105 0.000 0.00 0.00 H+0 HETATM 48 H UNK 0 -0.667 4.105 0.000 0.00 0.00 H+0 HETATM 49 C UNK 0 -0.024 6.251 0.000 0.00 0.00 C+0 HETATM 50 H UNK 0 0.667 7.627 0.000 0.00 0.00 H+0 HETATM 51 H UNK 0 -0.716 7.627 0.000 0.00 0.00 H+0 HETATM 52 C UNK 0 1.309 5.481 0.000 0.00 0.00 C+0 HETATM 53 H UNK 0 0.618 4.105 0.000 0.00 0.00 H+0 HETATM 54 H UNK 0 2.000 4.105 0.000 0.00 0.00 H+0 HETATM 55 C UNK 0 2.643 6.251 0.000 0.00 0.00 C+0 HETATM 56 H UNK 0 3.977 5.481 0.000 0.00 0.00 H+0 HETATM 57 C UNK 0 2.643 7.791 0.000 0.00 0.00 C+0 HETATM 58 H UNK 0 3.977 8.561 0.000 0.00 0.00 H+0 HETATM 59 C UNK 0 1.309 8.561 0.000 0.00 0.00 C+0 HETATM 60 H UNK 0 -0.161 9.018 0.000 0.00 0.00 H+0 HETATM 61 H UNK 0 2.643 9.331 0.000 0.00 0.00 H+0 HETATM 62 C UNK 0 1.309 10.101 0.000 0.00 0.00 C+0 HETATM 63 H UNK 0 0.463 11.388 0.000 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.228 10.191 0.000 0.00 0.00 H+0 HETATM 65 C UNK 0 2.643 10.871 0.000 0.00 0.00 C+0 HETATM 66 H UNK 0 3.334 12.247 0.000 0.00 0.00 H+0 HETATM 67 H UNK 0 1.952 12.247 0.000 0.00 0.00 H+0 HETATM 68 C UNK 0 3.977 10.101 0.000 0.00 0.00 C+0 HETATM 69 H UNK 0 3.977 11.641 0.000 0.00 0.00 H+0 HETATM 70 H UNK 0 5.310 9.331 0.000 0.00 0.00 H+0 HETATM 71 C UNK 0 5.310 10.871 0.000 0.00 0.00 C+0 HETATM 72 H UNK 0 6.490 11.861 0.000 0.00 0.00 H+0 HETATM 73 H UNK 0 5.578 12.388 0.000 0.00 0.00 H+0 HETATM 74 C UNK 0 6.644 10.101 0.000 0.00 0.00 C+0 HETATM 75 H UNK 0 6.678 8.562 0.000 0.00 0.00 H+0 HETATM 76 H UNK 0 8.010 9.390 0.000 0.00 0.00 H+0 HETATM 77 H UNK 0 7.924 10.957 0.000 0.00 0.00 H+0 HETATM 78 C UNK 0 -25.364 5.481 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 -26.134 6.815 0.000 0.00 0.00 C+0 HETATM 80 H UNK 0 -24.801 7.585 0.000 0.00 0.00 H+0 HETATM 81 H UNK 0 -26.904 8.149 0.000 0.00 0.00 H+0 HETATM 82 H UNK 0 -27.468 6.045 0.000 0.00 0.00 H+0 HETATM 83 C UNK 0 -24.594 4.147 0.000 0.00 0.00 C+0 HETATM 84 H UNK 0 -25.928 3.377 0.000 0.00 0.00 H+0 HETATM 85 H UNK 0 -23.824 2.814 0.000 0.00 0.00 H+0 HETATM 86 H UNK 0 -23.261 4.917 0.000 0.00 0.00 H+0 HETATM 87 C UNK 0 -26.698 4.711 0.000 0.00 0.00 C+0 HETATM 88 H UNK 0 -28.145 4.184 0.000 0.00 0.00 H+0 HETATM 89 H UNK 0 -27.225 3.264 0.000 0.00 0.00 H+0 HETATM 90 O UNK 0 -28.032 5.481 0.000 0.00 0.00 O+0 HETATM 91 P UNK 0 -29.365 4.711 0.000 0.00 0.00 P+0 HETATM 92 O UNK 0 -30.135 6.045 0.000 0.00 0.00 O-1 HETATM 93 O UNK 0 -28.595 3.377 0.000 0.00 0.00 O+0 HETATM 94 O UNK 0 -30.699 3.941 0.000 0.00 0.00 O+0 HETATM 95 P UNK 0 -32.033 4.711 0.000 0.00 0.00 P+0 HETATM 96 O UNK 0 -31.263 6.045 0.000 0.00 0.00 O-1 HETATM 97 O UNK 0 -32.803 3.377 0.000 0.00 0.00 O+0 HETATM 98 O UNK 0 -33.366 5.481 0.000 0.00 0.00 O+0 HETATM 99 C UNK 0 -34.700 4.711 0.000 0.00 0.00 C+0 HETATM 100 H UNK 0 -35.391 3.335 0.000 0.00 0.00 H+0 HETATM 101 H UNK 0 -34.009 3.335 0.000 0.00 0.00 H+0 HETATM 102 C UNK 0 -36.034 5.481 0.000 0.00 0.00 C+0 HETATM 103 H UNK 0 -34.742 6.320 0.000 0.00 0.00 H+0 HETATM 104 O UNK 0 -37.441 4.855 0.000 0.00 0.00 O+0 HETATM 105 C UNK 0 -38.471 5.999 0.000 0.00 0.00 C+0 HETATM 106 H UNK 0 -39.310 7.291 0.000 0.00 0.00 H+0 HETATM 107 N UNK 0 -40.003 5.838 0.000 0.00 0.00 N+0 HETATM 108 C UNK 0 -41.033 6.983 0.000 0.00 0.00 C+0 HETATM 109 H UNK 0 -41.485 8.455 0.000 0.00 0.00 H+0 HETATM 110 N UNK 0 -42.440 6.356 0.000 0.00 0.00 N+0 HETATM 111 C UNK 0 -42.279 4.825 0.000 0.00 0.00 C+0 HETATM 112 C UNK 0 -40.773 4.505 0.000 0.00 0.00 C+0 HETATM 113 N UNK 0 -40.297 3.040 0.000 0.00 0.00 N+0 HETATM 114 C UNK 0 -41.327 1.896 0.000 0.00 0.00 C+0 HETATM 115 H UNK 0 -40.851 0.431 0.000 0.00 0.00 H+0 HETATM 116 N UNK 0 -42.834 2.216 0.000 0.00 0.00 N+0 HETATM 117 C UNK 0 -43.309 3.680 0.000 0.00 0.00 C+0 HETATM 118 N UNK 0 -44.816 4.001 0.000 0.00 0.00 N+0 HETATM 119 H UNK 0 -45.292 5.465 0.000 0.00 0.00 H+0 HETATM 120 H UNK 0 -45.846 2.856 0.000 0.00 0.00 H+0 HETATM 121 C UNK 0 -37.701 7.333 0.000 0.00 0.00 C+0 HETATM 122 H UNK 0 -36.732 8.530 0.000 0.00 0.00 H+0 HETATM 123 O UNK 0 -38.327 8.740 0.000 0.00 0.00 O+0 HETATM 124 H UNK 0 -38.958 10.145 0.000 0.00 0.00 H+0 HETATM 125 C UNK 0 -36.195 7.013 0.000 0.00 0.00 C+0 HETATM 126 H UNK 0 -37.339 5.982 0.000 0.00 0.00 H+0 HETATM 127 O UNK 0 -35.050 8.043 0.000 0.00 0.00 O+0 HETATM 128 P UNK 0 -33.586 7.567 0.000 0.00 0.00 P+0 HETATM 129 O UNK 0 -34.062 6.103 0.000 0.00 0.00 O-1 HETATM 130 O UNK 0 -33.110 9.032 0.000 0.00 0.00 O-1 HETATM 131 O UNK 0 -32.121 7.091 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 5 78 CONECT 4 3 CONECT 5 3 6 7 CONECT 6 5 CONECT 7 5 8 9 CONECT 8 7 CONECT 9 7 10 11 12 CONECT 10 9 CONECT 11 9 CONECT 12 9 13 14 15 CONECT 13 12 CONECT 14 12 CONECT 15 12 16 17 CONECT 16 15 CONECT 17 15 18 19 CONECT 18 17 CONECT 19 17 20 21 22 CONECT 20 19 CONECT 21 19 CONECT 22 19 23 24 25 CONECT 23 22 CONECT 24 22 CONECT 25 22 26 CONECT 26 25 27 28 CONECT 27 26 CONECT 28 26 29 30 31 CONECT 29 28 CONECT 30 28 CONECT 31 28 32 33 34 CONECT 32 31 CONECT 33 31 CONECT 34 31 35 36 37 CONECT 35 34 CONECT 36 34 CONECT 37 34 38 39 40 CONECT 38 37 CONECT 39 37 CONECT 40 37 41 42 43 CONECT 41 40 CONECT 42 40 CONECT 43 40 44 45 46 CONECT 44 43 CONECT 45 43 CONECT 46 43 47 48 49 CONECT 47 46 CONECT 48 46 CONECT 49 46 50 51 52 CONECT 50 49 CONECT 51 49 CONECT 52 49 53 54 55 CONECT 53 52 CONECT 54 52 CONECT 55 52 56 57 CONECT 56 55 CONECT 57 55 58 59 CONECT 58 57 CONECT 59 57 60 61 62 CONECT 60 59 CONECT 61 59 CONECT 62 59 63 64 65 CONECT 63 62 CONECT 64 62 CONECT 65 62 66 67 68 CONECT 66 65 CONECT 67 65 CONECT 68 65 69 70 71 CONECT 69 68 CONECT 70 68 CONECT 71 68 72 73 74 CONECT 72 71 CONECT 73 71 CONECT 74 71 75 76 77 CONECT 75 74 CONECT 76 74 CONECT 77 74 CONECT 78 3 79 83 87 CONECT 79 78 80 81 82 CONECT 80 79 CONECT 81 79 CONECT 82 79 CONECT 83 78 84 85 86 CONECT 84 83 CONECT 85 83 CONECT 86 83 CONECT 87 78 88 89 90 CONECT 88 87 CONECT 89 87 CONECT 90 87 91 CONECT 91 90 92 93 94 CONECT 92 91 CONECT 93 91 CONECT 94 91 95 CONECT 95 94 96 97 98 CONECT 96 95 CONECT 97 95 CONECT 98 95 99 CONECT 99 98 100 101 102 CONECT 100 99 CONECT 101 99 CONECT 102 99 103 104 125 CONECT 103 102 CONECT 104 102 105 CONECT 105 104 106 107 121 CONECT 106 105 CONECT 107 105 108 112 CONECT 108 107 109 110 CONECT 109 108 CONECT 110 108 111 CONECT 111 110 112 117 CONECT 112 111 107 113 CONECT 113 112 114 CONECT 114 113 115 116 CONECT 115 114 CONECT 116 114 117 CONECT 117 116 111 118 CONECT 118 117 119 120 CONECT 119 118 CONECT 120 118 CONECT 121 105 122 123 125 CONECT 122 121 CONECT 123 121 124 CONECT 124 123 CONECT 125 121 102 126 127 CONECT 126 125 CONECT 127 125 128 CONECT 128 127 129 130 131 CONECT 129 128 CONECT 130 128 CONECT 131 128 MASTER 0 0 0 0 0 0 0 0 131 0 266 0 END