==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 09-NOV-04 1XY5 . 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,J.E.RI . 12 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1731.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 2 16.7 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 8.3 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 0 256 0, 0.0 2,-0.4 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 164.5 4.0 -7.0 6.2 2 2 A a - 0 0 67 10,-0.1 2,-0.3 9,-0.0 10,-0.0 -0.953 360.0-130.9-124.9 143.4 1.4 -5.2 4.2 3 3 A K + 0 0 124 -2,-0.4 8,-0.5 2,-0.0 7,-0.4 -0.657 31.1 168.9 -92.9 148.8 1.6 -4.0 0.6 4 4 A F - 0 0 136 -2,-0.3 3,-0.1 5,-0.2 8,-0.0 -0.953 38.6-143.1-152.1 167.8 0.7 -0.5 -0.5 5 5 A E - 0 0 101 -2,-0.3 2,-1.3 1,-0.1 -2,-0.0 0.013 57.4-103.5-123.3 23.7 0.9 1.9 -3.4 6 6 A X S S+ 0 0 222 1,-0.2 -1,-0.1 2,-0.1 3,-0.1 -0.734 105.2 1.9 93.1 -88.8 1.5 5.1 -1.3 7 7 A X S S+ 0 0 320 -2,-1.3 -1,-0.2 1,-0.1 -3,-0.0 0.040 132.1 60.2-119.0 22.2 -1.9 6.7 -1.5 8 8 A T S S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.218 70.6 155.1-130.4 8.1 -3.6 3.9 -3.5 9 9 A F + 0 0 108 1,-0.1 -5,-0.2 -3,-0.1 3,-0.0 0.114 7.2 156.7 -36.4 152.4 -3.1 1.1 -1.1 10 10 A X + 0 0 154 -7,-0.4 2,-0.2 0, 0.0 -6,-0.1 0.089 43.7 81.7-176.4 37.9 -5.6 -1.8 -1.4 11 11 A S 0 0 24 -8,-0.5 -9,-0.0 1,-0.0 -2,-0.0 -0.704 360.0 360.0-136.8-172.7 -4.0 -4.9 0.0 12 12 A a 0 0 118 -2,-0.2 -10,-0.1 -11,-0.1 -1,-0.0 0.588 360.0 360.0 57.9 360.0 -3.3 -6.6 3.3