HEADER PROTEIN 25-MAY-23 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 25-MAY-23 0 HETATM 1 C UNK 0 -0.744 4.882 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 3.103 10.799 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -13.518 14.458 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -11.086 16.348 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 7.290 4.562 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 2.594 5.313 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 2.887 6.730 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 1.362 6.519 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 3.467 8.156 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 1.298 2.398 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 2.573 1.534 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 10.322 4.020 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -6.415 12.177 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 8.806 4.291 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -7.361 13.393 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.419 11.383 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.474 10.167 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 9.853 1.394 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 7.344 0.488 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 5.774 4.833 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -20.659 19.635 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -13.247 16.619 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -29.305 18.069 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -26.207 22.114 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 0.781 5.093 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 2.522 9.372 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 8.337 1.666 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 10.845 2.572 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 1.726 3.877 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 3.789 2.479 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 6.297 3.385 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 5.828 0.759 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -22.185 19.424 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 4.258 5.104 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 -4.890 12.388 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 5.305 2.208 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 -28.449 21.027 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -24.427 18.337 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 -22.911 18.066 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -11.357 14.187 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 -29.944 20.658 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 -27.382 19.917 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -9.831 14.398 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 -24.638 19.862 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 0.997 9.162 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -12.302 15.403 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 7.813 3.114 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 3.266 3.927 0.000 0.00 0.00 C+0 HETATM 49 N UNK 0 -31.011 21.769 0.000 0.00 0.00 N+0 HETATM 50 N UNK 0 -3.945 11.172 0.000 0.00 0.00 N+0 HETATM 51 N UNK 0 -8.886 13.182 0.000 0.00 0.00 N+0 HETATM 52 N UNK 0 -30.372 19.179 0.000 0.00 0.00 N+0 HETATM 53 N UNK 0 -27.810 18.438 0.000 0.00 0.00 N+0 HETATM 54 N UNK 0 -27.722 22.385 0.000 0.00 0.00 N+0 HETATM 55 N UNK 0 -25.996 20.589 0.000 0.00 0.00 N+0 HETATM 56 O UNK 0 12.361 2.301 0.000 0.00 0.00 O+0 HETATM 57 O UNK 0 4.835 -0.418 0.000 0.00 0.00 O+0 HETATM 58 O UNK 0 3.735 6.553 0.000 0.00 0.00 O+0 HETATM 59 O UNK 0 -4.310 13.814 0.000 0.00 0.00 O-1 HETATM 60 O UNK 0 -25.538 17.270 0.000 0.00 0.00 O+0 HETATM 61 O UNK 0 -11.937 12.761 0.000 0.00 0.00 O+0 HETATM 62 O UNK 0 -9.251 15.825 0.000 0.00 0.00 O-1 HETATM 63 O UNK 0 0.416 7.735 0.000 0.00 0.00 O+0 HETATM 64 O UNK 0 -24.378 16.270 0.000 0.00 0.00 O-1 HETATM 65 O UNK 0 -21.829 14.541 0.000 0.00 0.00 O-1 HETATM 66 O UNK 0 -23.968 14.131 0.000 0.00 0.00 O+0 HETATM 67 O UNK 0 -17.978 17.104 0.000 0.00 0.00 O+0 HETATM 68 O UNK 0 -18.399 20.155 0.000 0.00 0.00 O+0 HETATM 69 O UNK 0 -16.934 16.679 0.000 0.00 0.00 O+0 HETATM 70 O UNK 0 -14.502 18.569 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 -19.714 18.419 0.000 0.00 0.00 O+0 HETATM 72 O UNK 0 -14.773 16.408 0.000 0.00 0.00 O+0 HETATM 73 O UNK 0 -23.252 20.534 0.000 0.00 0.00 O+0 HETATM 74 O UNK 0 -22.239 16.680 0.000 0.00 0.00 O+0 HETATM 75 O UNK 0 -16.663 18.840 0.000 0.00 0.00 O+0 HETATM 76 P UNK 0 -23.104 15.405 0.000 0.00 0.00 P+0 HETATM 77 P UNK 0 -18.189 18.629 0.000 0.00 0.00 P+0 HETATM 78 P UNK 0 -15.718 17.624 0.000 0.00 0.00 P+0 HETATM 79 S UNK 0 0.051 10.377 0.000 0.00 0.00 S+0 HETATM 80 H UNK 0 4.878 8.775 0.000 0.00 0.00 H+0 HETATM 81 H UNK 0 -0.164 6.309 0.000 0.00 0.00 H+0 HETATM 82 H UNK 0 8.860 0.217 0.000 0.00 0.00 H+0 HETATM 83 H UNK 0 11.838 3.749 0.000 0.00 0.00 H+0 HETATM 84 H UNK 0 0.214 3.587 0.000 0.00 0.00 H+0 HETATM 85 H UNK 0 4.782 3.656 0.000 0.00 0.00 H+0 HETATM 86 H UNK 0 6.821 1.937 0.000 0.00 0.00 H+0 HETATM 87 H UNK 0 6.351 -0.689 0.000 0.00 0.00 H+0 HETATM 88 H UNK 0 -21.680 20.879 0.000 0.00 0.00 H+0 HETATM 89 H UNK 0 5.251 6.282 0.000 0.00 0.00 H+0 HETATM 90 H UNK 0 4.312 1.030 0.000 0.00 0.00 H+0 HETATM 91 H UNK 0 -25.882 18.842 0.000 0.00 0.00 H+0 HETATM 92 H UNK 0 -21.372 18.035 0.000 0.00 0.00 H+0 HETATM 93 H UNK 0 -10.777 15.614 0.000 0.00 0.00 H+0 HETATM 94 H UNK 0 -24.607 21.402 0.000 0.00 0.00 H+0 CONECT 1 25 CONECT 2 26 CONECT 3 46 CONECT 4 46 CONECT 5 47 CONECT 6 48 CONECT 7 8 9 CONECT 8 7 25 CONECT 9 7 80 26 CONECT 10 11 29 CONECT 11 10 30 CONECT 12 14 28 CONECT 13 15 35 CONECT 14 12 47 CONECT 15 13 51 CONECT 16 17 50 CONECT 17 16 79 CONECT 18 27 28 CONECT 19 27 32 CONECT 20 31 34 CONECT 21 33 71 CONECT 22 46 72 CONECT 23 52 53 CONECT 24 54 55 CONECT 25 1 8 81 29 CONECT 26 2 9 45 CONECT 27 18 19 82 47 CONECT 28 12 18 83 56 CONECT 29 10 25 84 48 CONECT 30 11 85 36 48 CONECT 31 20 86 36 47 CONECT 32 19 87 36 57 CONECT 33 21 88 39 73 CONECT 34 20 89 48 58 CONECT 35 13 50 59 CONECT 36 30 31 32 90 CONECT 37 41 42 54 CONECT 38 91 39 44 60 CONECT 39 33 38 92 74 CONECT 40 93 43 46 61 CONECT 41 37 49 52 CONECT 42 37 53 55 CONECT 43 40 51 62 CONECT 44 38 94 55 73 CONECT 45 26 63 79 CONECT 46 3 4 22 40 CONECT 47 5 14 27 31 CONECT 48 6 29 30 34 CONECT 49 41 CONECT 50 16 35 CONECT 51 15 43 CONECT 52 23 41 CONECT 53 23 42 CONECT 54 24 37 CONECT 55 24 42 44 CONECT 56 28 CONECT 57 32 CONECT 58 34 CONECT 59 35 CONECT 60 38 CONECT 61 40 CONECT 62 43 CONECT 63 45 CONECT 64 76 CONECT 65 76 CONECT 66 76 CONECT 67 77 CONECT 68 77 CONECT 69 78 CONECT 70 78 CONECT 71 21 77 CONECT 72 22 78 CONECT 73 33 44 CONECT 74 39 76 CONECT 75 77 78 CONECT 76 64 65 66 74 CONECT 77 67 68 71 75 CONECT 78 69 70 72 75 CONECT 79 17 45 CONECT 80 9 CONECT 81 25 CONECT 82 27 CONECT 83 28 CONECT 84 29 CONECT 85 30 CONECT 86 31 CONECT 87 32 CONECT 88 33 CONECT 89 34 CONECT 90 36 CONECT 91 38 CONECT 92 39 CONECT 93 40 CONECT 94 44 MASTER 0 0 0 0 0 0 0 0 94 0 200 0 END