==== 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 1XY4 . 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) . 1631.0 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 . 1 8.3 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 . 1 8.3 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,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-165.7 -4.5 -8.4 1.0 2 2 A a - 0 0 64 2,-0.0 2,-0.3 8,-0.0 10,-0.2 -0.432 360.0-171.1 -83.5 161.0 -1.5 -6.2 0.6 3 3 A K - 0 0 120 -2,-0.1 8,-2.0 1,-0.0 9,-0.1 -0.916 23.5-168.6-158.0 127.0 -1.7 -2.4 0.2 4 4 A E > - 0 0 79 -2,-0.3 4,-2.6 1,-0.3 6,-0.1 0.100 35.1-155.3-101.3 19.5 0.9 0.2 -0.7 5 5 A F T 4 - 0 0 91 1,-0.2 2,-3.3 2,-0.2 -1,-0.3 0.091 67.7 -5.7 37.7-151.8 -1.4 3.0 0.2 6 6 A X T 4 S- 0 0 230 1,-0.2 -1,-0.2 -3,-0.1 3,-0.1 -0.394 122.5 -70.0 -68.7 72.2 -0.7 6.3 -1.5 7 7 A X T 4 S+ 0 0 276 -2,-3.3 -1,-0.2 1,-0.1 -2,-0.2 0.861 117.3 96.1 38.4 50.5 2.5 4.9 -3.0 8 8 A T S < S+ 0 0 91 -4,-2.6 -1,-0.1 1,-0.5 -3,-0.0 -0.176 70.8 8.8-132.1-135.5 4.0 4.9 0.5 9 9 A F S S- 0 0 130 -2,-0.1 -1,-0.5 -3,-0.1 2,-0.4 0.161 70.8-120.9 -44.1 170.1 4.4 2.3 3.3 10 10 A K - 0 0 111 -3,-0.1 -6,-0.2 -6,-0.1 -1,-0.1 -0.974 25.1-178.5-125.1 137.1 3.5 -1.3 2.7 11 11 A S 0 0 56 -8,-2.0 -7,-0.1 -2,-0.4 -1,-0.0 -0.169 360.0 360.0-123.7 36.6 1.0 -3.4 4.5 12 12 A a 0 0 127 -10,-0.2 -1,-0.1 -9,-0.1 -8,-0.0 0.987 360.0 360.0 -68.0 360.0 1.6 -6.7 2.7