@MOLECULE n~6~-{[5-(dimethylamino)-1-naphthyl]sulfonyl}-l-lysine 51 52 0 0 0 SMALL USER_CHARGES @ATOM 1 S1 3.2750 -0.6082 0.0356 S.O2 1 <1> 2.3554 2 O1 3.7319 -1.3802 1.1671 O.2 1 <1> -0.8989 3 O2 4.1281 -0.3821 -1.1113 O.2 1 <1> -0.9306 4 O3 -2.3221 3.6058 -1.4318 O.3 1 <1> -0.5470 5 O4 -2.8575 1.4609 -1.1795 O.2 1 <1> -0.5466 6 N1 2.8792 0.9437 0.7143 N.3 1 <1> -0.8766 7 N2 -3.0039 -2.3323 -0.1732 N.pl3 1 <1> -0.4060 8 N3 -2.1401 1.4867 1.5560 N.3 1 <1> -0.6368 9 C1 1.8023 3.1161 0.3344 C.3 1 <1> -0.2806 10 C2 0.4027 2.5342 0.1064 C.3 1 <1> -0.2678 11 C3 2.8857 2.1307 -0.1547 C.3 1 <1> -0.0516 12 C4 -0.6611 3.3679 0.8273 C.3 1 <1> -0.2965 13 C5 1.7324 -1.1915 -0.5740 C.ar 1 <1> -0.4099 14 C6 0.5940 -1.3753 0.2626 C.ar 1 <1> 0.0901 15 C7 -2.0572 2.7240 0.7594 C.3 1 <1> -0.0060 16 C8 -0.6285 -1.7725 -0.3368 C.ar 1 <1> -0.0935 17 C9 -1.8094 -1.9012 0.4758 C.ar 1 <1> 0.1927 18 C10 1.6585 -1.4494 -1.9231 C.ar 1 <1> -0.0282 19 C11 0.6321 -1.1920 1.6734 C.ar 1 <1> -0.2238 20 C12 -0.6574 -2.0759 -1.7236 C.ar 1 <1> -0.0541 21 C13 0.4590 -1.9141 -2.5036 C.ar 1 <1> -0.2170 22 C14 -1.7312 -1.6865 1.8374 C.ar 1 <1> -0.2962 23 C15 -0.4970 -1.3514 2.4330 C.ar 1 <1> -0.0855 24 C16 -2.4480 2.4821 -0.6897 C.2 1 <1> 0.6037 25 C17 -3.6508 -1.2721 -0.9748 C.3 1 <1> -0.2659 26 C18 -3.9796 -3.0042 0.7064 C.3 1 <1> -0.2635 27 H1 1.9105 4.0788 -0.1963 H 1 <1> 0.1341 28 H2 1.9542 3.3371 1.4074 H 1 <1> 0.1407 29 H3 0.3847 1.4830 0.4662 H 1 <1> 0.1614 30 H4 0.1852 2.4841 -0.9770 H 1 <1> 0.1382 31 H5 3.8803 2.6312 -0.1562 H 1 <1> 0.1220 32 H6 2.6838 1.8446 -1.2120 H 1 <1> 0.1480 33 H7 -0.3833 3.5040 1.8928 H 1 <1> 0.1599 34 H8 -0.7042 4.3860 0.3912 H 1 <1> 0.1583 35 H9 3.2414 1.1295 1.6439 H 1 <1> 0.3024 36 H10 -2.8188 3.4345 1.2013 H 1 <1> 0.1834 37 H11 2.5254 -1.3091 -2.5860 H 1 <1> 0.1794 38 H12 1.5745 -0.9517 2.1708 H 1 <1> 0.1861 39 H13 -1.5835 -2.4639 -2.1589 H 1 <1> 0.1708 40 H14 0.4353 -2.1445 -3.5661 H 1 <1> 0.1579 41 H15 -2.6075 -1.7689 2.4751 H 1 <1> 0.1652 42 H16 -0.4598 -1.2176 3.5156 H 1 <1> 0.1556 43 H17 -2.7008 0.7736 1.1063 H 1 <1> 0.2675 44 H18 -1.2247 1.0867 1.7296 H 1 <1> 0.2656 45 H19 -2.9075 -0.7507 -1.6034 H 1 <1> 0.1658 46 H20 -4.1612 -0.5066 -0.3685 H 1 <1> 0.1370 47 H21 -4.3877 -1.7393 -1.6496 H 1 <1> 0.1532 48 H22 -4.5038 -2.3329 1.4034 H 1 <1> 0.1256 49 H23 -3.4728 -3.7958 1.2848 H 1 <1> 0.1535 50 H24 -4.7326 -3.4982 0.0667 H 1 <1> 0.1529 51 H25 -2.5929 3.4895 -2.3778 H 1 <1> 0.3561 @BOND 1 3 1 2 2 37 18 1 3 31 11 1 4 1 2 2 5 1 6 1 6 1 13 1 7 32 11 1 8 18 13 ar 9 18 21 ar 10 11 6 1 11 11 9 1 12 40 21 1 13 6 35 1 14 13 14 ar 15 21 20 ar 16 27 9 1 17 9 28 1 18 9 10 1 19 14 19 ar 20 14 16 ar 21 38 19 1 22 20 39 1 23 20 16 ar 24 30 10 1 25 19 23 ar 26 10 29 1 27 10 12 1 28 16 17 ar 29 23 42 1 30 23 22 ar 31 34 12 1 32 12 33 1 33 12 15 1 34 17 22 ar 35 17 7 1 36 51 4 1 37 45 25 1 38 4 24 1 39 44 8 1 40 22 41 1 41 5 24 2 42 24 15 1 43 7 25 1 44 7 26 1 45 15 8 1 46 15 36 1 47 25 47 1 48 25 46 1 49 8 43 1 50 49 26 1 51 26 50 1 52 26 48 1