@MOLECULE histidyl-n-2-naphthylprolinamide 51 54 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2728 -1.8132 1.7833 O.2 1 UNL1111111111 -0.5519 2 O -0.2473 0.2612 -0.4755 O.2 1 UNL1111111111 -0.5585 3 N -2.4774 -1.3574 -0.3986 N.am 1 UNL1111111111 -0.5009 4 N 1.2316 -1.4532 -0.4362 N.am 1 UNL1111111111 -0.5573 5 N -5.0351 -1.3780 2.1852 N.3 1 UNL1111111111 -0.6189 6 N -2.2400 1.9202 0.3415 N.ar 1 UNL1111111111 -0.3411 7 N -3.4861 3.3373 -0.8760 N.ar 1 UNL1111111111 -0.3929 8 C -1.1838 -1.9540 -0.7334 C.3 1 UNL1111111111 0.0199 9 C -1.2764 -2.2388 -2.2502 C.3 1 UNL1111111111 -0.2784 10 C -2.2276 -1.1513 -2.7821 C.3 1 UNL1111111111 -0.2755 11 C -3.1349 -0.7832 -1.5874 C.3 1 UNL1111111111 -0.0609 12 C -2.9241 -1.2906 0.8970 C.2 1 UNL1111111111 0.5144 13 C -0.0521 -0.9332 -0.5096 C.2 1 UNL1111111111 0.5815 14 C -4.2704 -0.6059 1.1953 C.3 1 UNL1111111111 -0.0033 15 C -3.9788 0.7926 1.7909 C.3 1 UNL1111111111 -0.2764 16 C -3.5652 1.7543 0.7550 C.ar 1 UNL1111111111 -0.0323 17 C 2.3905 -0.6423 -0.3022 C.ar 1 UNL1111111111 0.2247 18 C 3.5367 -1.2308 0.1957 C.ar 1 UNL1111111111 -0.2738 19 C 2.4001 0.7206 -0.7158 C.ar 1 UNL1111111111 -0.1848 20 C -4.3179 2.6621 0.0015 C.ar 1 UNL1111111111 -0.0876 21 C 4.7224 -0.4658 0.3340 C.ar 1 UNL1111111111 0.0385 22 C 4.7223 0.9001 -0.0229 C.ar 1 UNL1111111111 -0.0478 23 C 3.5381 1.4673 -0.5677 C.ar 1 UNL1111111111 -0.1168 24 C -2.2396 2.8713 -0.6761 C.ar 1 UNL1111111111 0.0807 25 C 5.9174 -1.0496 0.8443 C.ar 1 UNL1111111111 -0.1702 26 C 5.9053 1.6681 0.1555 C.ar 1 UNL1111111111 -0.1313 27 C 7.0447 -0.2889 1.0043 C.ar 1 UNL1111111111 -0.1288 28 C 7.0421 1.0844 0.6526 C.ar 1 UNL1111111111 -0.1628 29 H -1.0211 -2.8733 -0.1167 H 1 UNL1111111111 0.1758 30 H -0.2961 -2.2137 -2.7502 H 1 UNL1111111111 0.1564 31 H -1.6977 -3.2443 -2.4242 H 1 UNL1111111111 0.1550 32 H -1.6580 -0.2671 -3.1238 H 1 UNL1111111111 0.1598 33 H -2.8123 -1.4958 -3.6477 H 1 UNL1111111111 0.1490 34 H -3.2424 0.3202 -1.4872 H 1 UNL1111111111 0.1616 35 H -4.1489 -1.2199 -1.7011 H 1 UNL1111111111 0.1367 36 H -4.8984 -0.5051 0.2738 H 1 UNL1111111111 0.1626 37 H -3.2230 0.7069 2.6033 H 1 UNL1111111111 0.1747 38 H -4.9061 1.1542 2.3014 H 1 UNL1111111111 0.1920 39 H 1.3648 -2.4531 -0.3231 H 1 UNL1111111111 0.3162 40 H -4.5216 -1.4919 3.0507 H 1 UNL1111111111 0.2690 41 H -5.2933 -2.2896 1.8420 H 1 UNL1111111111 0.2537 42 H 3.5547 -2.2743 0.4978 H 1 UNL1111111111 0.1623 43 H 1.5044 1.1679 -1.1517 H 1 UNL1111111111 0.1930 44 H -1.4855 1.2976 0.5688 H 1 UNL1111111111 0.3441 45 H -5.3673 2.8721 0.0390 H 1 UNL1111111111 0.1758 46 H 3.5527 2.5138 -0.8739 H 1 UNL1111111111 0.1580 47 H -1.3482 3.1942 -1.1876 H 1 UNL1111111111 0.1895 48 H 5.9121 -2.1072 1.0989 H 1 UNL1111111111 0.1535 49 H 5.8896 2.7236 -0.1107 H 1 UNL1111111111 0.1527 50 H 7.9621 -0.7195 1.4035 H 1 UNL1111111111 0.1499 51 H 7.9582 1.6563 0.7825 H 1 UNL1111111111 0.1511 @BOND 1 1 12 2 2 2 13 2 3 3 8 1 4 3 11 1 5 3 12 am 6 4 13 am 7 4 17 1 8 4 39 1 9 5 14 1 10 5 40 1 11 5 41 1 12 6 16 ar 13 6 24 ar 14 6 44 1 15 7 20 ar 16 7 24 ar 17 8 9 1 18 8 13 1 19 8 29 1 20 9 10 1 21 9 30 1 22 9 31 1 23 10 11 1 24 10 32 1 25 10 33 1 26 11 34 1 27 11 35 1 28 12 14 1 29 14 15 1 30 14 36 1 31 15 16 1 32 15 37 1 33 15 38 1 34 16 20 ar 35 17 18 ar 36 17 19 ar 37 18 21 ar 38 18 42 1 39 19 23 ar 40 19 43 1 41 20 45 1 42 21 22 ar 43 21 25 ar 44 22 23 ar 45 22 26 ar 46 23 46 1 47 24 47 1 48 25 27 ar 49 25 48 1 50 26 28 ar 51 26 49 1 52 27 28 ar 53 27 50 1 54 28 51 1