D0D2TZ 06060800382D 1 1.00000 0.00000 0 28 28 0 1 0 999 V2000 -2.5698 -3.0358 0.0000 N 0 0 0 0 0 0 0 0 0 -1.9783 -2.6033 0.0000 C 0 0 2 0 0 0 0 0 0 -1.3526 -3.7775 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3554 -3.0244 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9780 -1.8483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3292 -0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3292 -1.4708 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6796 -1.8458 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0301 -1.4708 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0301 -0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6796 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0.6194 -0.3458 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8948 -3.0267 0.0000 N 0 0 0 0 0 0 0 0 0 -0.3033 -3.4592 0.0000 C 0 0 2 0 0 0 0 0 0 0.3224 -2.2850 0.0000 O 0 0 0 0 0 0 0 0 0 0.3196 -3.0381 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3030 -4.2142 0.0000 C 0 0 0 0 0 0 0 0 0 0.3467 -4.5890 0.0000 O 0 0 0 0 0 0 0 0 0 0.7802 -3.0358 0.0000 N 0 0 0 0 0 0 0 0 0 1.3717 -2.6033 0.0000 C 0 0 2 0 0 0 0 0 0 1.9974 -3.7775 0.0000 O 0 0 0 0 0 0 0 0 0 1.9946 -3.0244 0.0000 C 0 0 0 0 0 0 0 0 0 1.3720 -1.8483 0.0000 C 0 0 0 0 0 0 0 0 0 2.0217 -1.4735 0.0000 C 0 0 3 0 0 0 0 0 0 2.0220 -0.7235 0.0000 C 0 0 0 0 0 0 0 0 0 2.6710 -1.8488 0.0000 C 0 0 0 0 0 0 0 0 0 2.2083 -3.0250 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7917 -3.0208 0.0000 H 0 0 0 0 0 0 0 0 0 11 6 1 0 0 0 4 3 2 0 0 0 10 12 1 0 0 0 2 5 1 1 0 0 16 19 1 0 0 0 13 14 1 0 0 0 14 16 1 0 0 0 16 15 2 0 0 0 14 17 1 6 0 0 5 7 1 0 0 0 22 27 1 0 0 0 17 18 1 0 0 0 6 7 2 0 0 0 7 8 1 0 0 0 19 20 1 0 0 0 20 22 1 0 0 0 22 21 2 0 0 0 20 23 1 1 0 0 4 13 1 0 0 0 8 9 2 0 0 0 1 2 1 0 0 0 23 24 1 0 0 0 9 10 1 0 0 0 24 25 1 0 0 0 2 4 1 0 0 0 24 26 1 0 0 0 10 11 2 0 0 0 1 28 1 0 0 0 M STY 5 1 SUP 2 SUP 3 SUP 4 SUP 5 SUP M SLB 5 1 1 2 3 3 4 4 5 5 6 M SAL 1 6 13 14 15 16 17 18 M SBL 1 2 5 19 M SMT 1 Ser M SBV 1 19 -0.4600 0.0000 M SBV 1 5 0.4600 0.0000 M SCL 1 AA M SAP 1 2 13 4 Al 16 19 Br M SAL 2 8 19 20 21 22 23 24 25 26 M SBL 2 2 5 11 M SMT 2 Leu M SBV 2 5 -0.4600 0.0000 M SBV 2 11 0.2100 0.0000 M SCL 2 AA M SAP 2 2 19 16 Al 22 27 Br M SAL 3 12 1 2 3 4 5 6 7 8 9 10 11 12 M SBL 3 2 19 28 M SMT 3 Tyr M SBV 3 19 0.4600 0.0000 M SCL 3 AA M SAP 3 2 4 13 Br 1 0 Al M SAL 4 1 27 M SBL 4 1 11 M SMT 4 COOH M SBV 4 11 -0.2100 0.0000 M SCL 4 LGRP M SAL 5 1 28 M SBL 5 1 28 M SMT 5 NH2 M END $$$$