==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 09-NOV-04 1XXZ . COMPND 2 MOLECULE: SST1-SELECTIVE SOMATOSATIN (ANALOG 5); . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.R.R.GRACE,L.DURRER,S.C.KOERBER,J.ERCHEGYI,J.C.REUBI, . 11 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1586.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1 9.1 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 . 1 9.1 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 a 0 0 147 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-158.0 3.5 -6.9 -3.7 2 2 A K + 0 0 123 1,-0.1 8,-0.2 0, 0.0 3,-0.1 -0.559 360.0 172.0-139.3 70.1 2.5 -3.8 -1.7 3 3 A F - 0 0 145 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.876 62.3 -79.9 -44.4 -47.0 3.3 -4.5 2.0 4 4 A F S S+ 0 0 125 -3,-0.1 -1,-0.1 4,-0.1 4,-0.1 -0.969 78.3 106.4 170.9-161.2 2.4 -0.9 2.7 5 5 A X S S+ 0 0 205 -2,-0.3 2,-2.2 1,-0.1 0, 0.0 -0.181 72.1 50.1 85.4 177.2 3.8 2.6 2.7 6 6 A X S S- 0 0 302 -2,-0.1 2,-0.2 3,-0.0 -1,-0.1 -0.325 119.3 -47.6 58.1 -81.0 2.8 5.4 0.2 7 7 A T S S+ 0 0 62 -2,-2.2 -2,-0.1 1,-0.3 0, 0.0 -0.654 102.2 3.7-153.8-151.0 -1.0 4.9 0.8 8 8 A X + 0 0 255 -2,-0.2 -1,-0.3 -4,-0.1 2,-0.3 -0.105 65.2 173.6 -46.5 139.5 -3.6 2.2 0.9 9 9 A T - 0 0 30 1,-0.1 -6,-0.1 -6,-0.1 -4,-0.1 -0.991 25.1-171.8-153.0 149.7 -2.2 -1.3 0.6 10 10 A S 0 0 117 -2,-0.3 -1,-0.1 -8,-0.2 0, 0.0 0.754 360.0 360.0-103.4 -86.9 -3.5 -4.9 0.9 11 11 A a 0 0 75 -7,-0.0 0, 0.0 0, 0.0 0, 0.0 0.062 360.0 360.0 -66.2 360.0 -0.8 -7.5 0.8