==== 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 1XY8 . COMPND 2 MOLECULE: SST1-SELECTIVE SOMATOSATIN ANALOG; . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.R.R.GRACE,L.DURRER,S.C.KOERBER,J.ERCHEGYI,J.C.REUBI, . 12 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1665.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 4 33.3 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 16.7 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 Y 0 0 266 0, 0.0 11,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.7 6.0 -7.5 -1.0 2 2 A a + 0 0 79 9,-0.1 10,-0.6 10,-0.1 8,-0.0 0.800 360.0 145.4 -93.1 -94.0 3.2 -6.3 1.2 3 3 A K - 0 0 163 8,-0.2 9,-0.8 9,-0.1 6,-0.0 0.443 54.6-109.2 63.6 148.6 3.4 -2.7 2.3 4 4 A F - 0 0 99 7,-0.2 6,-0.3 1,-0.2 2,-0.3 0.986 54.8-105.0 -71.6 -80.5 0.3 -0.6 2.7 5 5 A E - 0 0 37 4,-0.2 -1,-0.2 1,-0.2 6,-0.0 -0.880 29.9 -75.7 162.8 168.8 0.3 1.9 -0.1 6 6 A X S S- 0 0 259 -2,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.950 123.6 -19.2 -50.5 -55.8 0.9 5.5 -1.1 7 7 A X S S+ 0 0 264 -3,-0.1 -1,-0.1 0, 0.0 -2,-0.1 0.638 131.5 67.4-122.0 -38.6 -2.4 6.5 0.5 8 8 A T S S- 0 0 39 -4,-0.1 -3,-0.1 1,-0.1 -4,-0.0 0.031 70.8-136.5 -74.0-172.7 -4.4 3.2 0.7 9 9 A F + 0 0 127 -5,-0.2 2,-3.4 2,-0.0 -4,-0.2 -0.054 41.7 150.6-139.8 31.5 -3.5 0.3 2.9 10 10 A X - 0 0 154 -6,-0.3 2,-1.1 2,-0.1 -2,-0.1 -0.365 30.5-166.4 -68.0 69.4 -4.1 -2.6 0.6 11 11 A S 0 0 63 -2,-3.4 -7,-0.2 1,-0.3 -8,-0.2 -0.477 360.0 360.0 -64.6 99.0 -1.4 -4.7 2.4 12 12 A a 0 0 115 -2,-1.1 -1,-0.3 -9,-0.8 -2,-0.1 0.747 360.0 360.0 43.0 360.0 -0.9 -7.5 -0.0