@MOLECULE l-prolyl-l-tyrosine 38 39 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.4419 1.2642 -1.7939 O.2 1 PRO1111 -0.5257 2 O -3.7311 0.1590 1.4599 O.3 2 TYR2222 -0.5636 3 OXT -4.6989 0.1225 -0.5504 O.2 2 TYR2222 -0.4840 4 OH 3.7385 -2.0347 -0.2298 O.3 2 TYR2222 -0.4701 5 N 1.2319 1.4411 1.2601 N.3 1 PRO1111 -0.5344 6 N -1.4057 0.8306 0.2064 N.am 2 TYR2222 -0.5864 7 CA 0.6206 2.2289 0.1526 C.3 1 PRO1111 -0.0426 8 CB 1.7578 2.6849 -0.7936 C.3 1 PRO1111 -0.2906 9 CG 3.0645 2.4160 -0.0282 C.3 1 PRO1111 -0.3013 10 CD 2.6225 1.9533 1.3784 C.3 1 PRO1111 -0.1076 11 C -0.4261 1.4054 -0.5892 C.2 1 PRO1111 0.5536 12 CA -2.2732 -0.1854 -0.3772 C.3 2 TYR2222 0.0337 13 CB -1.8558 -1.6246 0.0216 C.3 2 TYR2222 -0.3073 14 CG -0.3688 -1.7876 -0.0364 C.ar 2 TYR2222 -0.0714 15 C -3.6983 0.0550 0.1069 C.2 2 TYR2222 0.6083 16 CD1 0.3113 -1.6370 -1.2529 C.ar 2 TYR2222 -0.0834 17 CD2 0.3436 -2.0608 1.1310 C.ar 2 TYR2222 -0.0969 18 CE1 1.6938 -1.7356 -1.3035 C.ar 2 TYR2222 -0.2413 19 CE2 1.7332 -2.1659 1.1056 C.ar 2 TYR2222 -0.3204 20 CZ 2.3858 -1.9946 -0.1145 C.ar 2 TYR2222 0.2770 21 HA 0.1245 3.1200 0.6209 H 1 PRO1111 0.1707 22 HB1 1.6470 3.7477 -1.0585 H 1 PRO1111 0.1479 23 HB2 1.7324 2.1334 -1.7528 H 1 PRO1111 0.1710 24 HG1 3.6631 1.6383 -0.5312 H 1 PRO1111 0.1464 25 HG2 3.7011 3.3115 0.0233 H 1 PRO1111 0.1437 26 HD1 3.2894 1.1835 1.8024 H 1 PRO1111 0.1310 27 HD2 2.6073 2.8052 2.0908 H 1 PRO1111 0.1472 28 H 1.2444 0.4416 1.0375 H 1 PRO1111 0.2597 29 HA -2.2619 -0.0822 -1.5062 H 2 TYR2222 0.2071 30 H -1.3378 0.8523 1.2190 H 2 TYR2222 0.3354 31 HB1 -2.2370 -1.8628 1.0376 H 2 TYR2222 0.1661 32 HB2 -2.3504 -2.3528 -0.6559 H 2 TYR2222 0.1680 33 HD1 -0.2478 -1.4150 -2.1655 H 2 TYR2222 0.1727 34 HD2 -0.1831 -2.1877 2.0773 H 2 TYR2222 0.1567 35 HE1 2.2419 -1.6103 -2.2351 H 2 TYR2222 0.1818 36 HE2 2.2867 -2.3763 2.0140 H 2 TYR2222 0.1641 37 H -4.6326 0.3380 1.8243 H 2 TYR2222 0.3572 38 HH 4.1784 -2.3191 0.6074 H 2 TYR2222 0.3275 @BOND 1 1 11 2 2 2 15 1 3 2 37 1 4 3 15 2 5 4 20 1 6 4 38 1 7 5 7 1 8 5 10 1 9 5 28 1 10 6 11 am 11 6 12 1 12 6 30 1 13 7 8 1 14 7 11 1 15 7 21 1 16 8 9 1 17 8 22 1 18 8 23 1 19 9 10 1 20 9 24 1 21 9 25 1 22 10 26 1 23 10 27 1 24 12 13 1 25 12 15 1 26 12 29 1 27 13 14 1 28 13 31 1 29 13 32 1 30 14 16 ar 31 14 17 ar 32 16 18 ar 33 16 33 1 34 17 19 ar 35 17 34 1 36 18 20 ar 37 18 35 1 38 19 20 ar 39 19 36 1