==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOSUPPRESSANT 24-FEB-92 1CYA . COMPND 2 MOLECULE: CYCLOSPORIN A; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.W.FESIK . 11 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1304.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 2 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 2 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 74 0, 0.0 2,-0.4 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0-165.3 -2.3 -6.0 -3.4 2 2 A X + 0 0 184 9,-0.2 2,-0.2 2,-0.0 9,-0.1 -0.614 360.0 137.4-121.7 73.5 1.3 -6.5 -2.1 3 3 A X - 0 0 101 7,-0.4 2,-0.2 -2,-0.4 6,-0.0 -0.683 47.8-144.8-116.8 170.8 2.7 -2.9 -1.7 4 4 A X + 0 0 152 -2,-0.2 2,-0.1 2,-0.0 5,-0.1 -0.511 38.6 149.8-126.3 66.9 4.7 -0.8 0.8 5 5 A X - 0 0 162 -2,-0.2 2,-0.5 5,-0.1 4,-0.1 -0.363 47.7-116.8 -92.0-177.5 3.3 2.8 1.0 6 6 A X S S- 0 0 123 2,-0.1 2,-0.0 -2,-0.1 -2,-0.0 -0.700 89.3 -5.9-116.2 78.7 3.4 5.2 4.0 7 7 A X S S+ 0 0 76 -2,-0.5 2,-0.7 0, 0.0 -2,-0.0 -0.421 125.2 48.6 138.5 -65.7 -0.2 6.0 5.1 8 8 A X + 0 0 127 -2,-0.0 2,-0.4 2,-0.0 -2,-0.1 -0.807 64.5 177.3-112.2 92.6 -2.9 4.6 2.6 9 9 A V - 0 0 82 -2,-0.7 2,-0.2 -4,-0.1 -5,-0.0 -0.794 9.2-172.4 -91.7 133.7 -2.0 1.0 2.0 10 10 A X 0 0 126 -2,-0.4 -7,-0.4 1,-0.2 -5,-0.1 -0.732 360.0 360.0-121.8 173.2 -4.6 -0.8 -0.3 11 11 A A 0 0 97 -2,-0.2 -1,-0.2 -9,-0.1 -9,-0.2 0.021 360.0 360.0 -45.0 360.0 -5.2 -4.5 -1.4