==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN, CONTRACTILE PROTEIN 15-NOV-11 2LLP . COMPND 2 MOLECULE: COLLAGEN ALPHA-1(I) CHAIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR I.BERTINI,M.FRAGAI,C.LUCHINAT,M.MELIKIAN,M.TOCCAFONDI,J.L.LA . 48 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3714.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 21 43.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 8.3 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 . 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+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 . 2 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 1 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 13 A G 0 0 105 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.7 -20.0 -8.6 5.5 2 14 A P - 0 0 100 0, 0.0 2,-0.1 0, 0.0 0, 0.0 -0.163 360.0-107.1 -72.0 168.4 -16.7 -8.1 3.5 3 15 A Q - 0 0 76 33,-0.2 19,-0.2 16,-0.2 18,-0.2 -0.224 43.1 -71.7 -92.5 175.3 -14.0 -5.6 4.2 4 16 A G B -a 22 0A 4 16,-1.0 19,-0.8 17,-0.9 -1,-0.2 -0.032 56.0 -77.2 -74.9 173.5 -12.9 -2.3 2.5 5 17 A I - 0 0 105 32,-0.4 35,-2.2 17,-0.2 17,-0.2 -0.381 61.0 -90.5 -71.5 145.1 -11.2 -1.5 -0.8 6 18 A A - 0 0 55 33,-0.2 18,-0.2 16,-0.2 -1,-0.1 -0.270 50.3 -97.5 -61.9 139.9 -7.4 -2.0 -0.9 7 19 A G - 0 0 0 16,-2.9 19,-0.5 34,-0.2 35,-0.2 0.120 46.1 -80.1 -52.5 161.1 -5.1 0.9 -0.0 8 20 A Q - 0 0 87 32,-0.5 35,-1.9 17,-0.2 2,-0.1 -0.249 57.2 -87.6 -68.2 148.9 -3.4 3.3 -2.4 9 21 A R - 0 0 178 16,-0.2 18,-0.2 33,-0.1 -1,-0.1 -0.414 46.2-121.6 -61.9 130.4 -0.1 2.3 -4.1 10 22 A G - 0 0 7 16,-2.9 34,-0.2 -2,-0.1 19,-0.2 -0.351 34.8 -90.5 -69.0 150.4 2.9 3.1 -2.0 11 23 A V - 0 0 101 32,-0.5 35,-1.3 17,-0.2 17,-1.0 -0.279 54.0 -88.1 -64.0 145.1 5.7 5.4 -3.5 12 24 A V - 0 0 102 33,-0.2 18,-0.2 16,-0.2 -1,-0.1 -0.057 40.9-109.1 -52.8 149.7 8.6 3.8 -5.4 13 25 A G - 0 0 8 16,-1.3 35,-0.2 32,-0.2 34,-0.2 -0.391 37.1-111.6 -73.2 158.6 11.8 2.5 -3.7 14 26 A L - 0 0 80 32,-0.4 17,-1.6 1,-0.1 -1,-0.1 -0.527 15.4-140.8 -89.2 158.0 15.1 4.4 -4.2 15 27 A P 0 0 65 0, 0.0 34,-1.6 0, 0.0 -1,-0.1 -0.131 360.0 360.0 -78.2-166.0 18.3 3.5 -6.0 16 28 A G 0 0 123 16,-1.3 16,-0.0 32,-0.2 34,-0.0 -0.755 360.0 360.0 -65.0 360.0 21.6 4.4 -4.6 17 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 18 12 B P 0 0 147 0, 0.0 19,-0.2 0, 0.0 -15,-0.0 0.000 360.0 360.0 360.0-154.8 -20.4 -2.6 8.2 19 13 B G - 0 0 16 17,-1.3 -16,-0.2 16,-0.6 2,-0.1 -0.548 360.0-111.7 -68.0 159.6 -17.2 -4.2 6.8 20 14 B P - 0 0 91 0, 0.0 -16,-1.0 0, 0.0 -1,-0.1 -0.289 57.9 -62.0 -72.1 177.4 -14.0 -3.5 8.8 21 15 B Q - 0 0 110 -18,-0.2 -17,-0.9 16,-0.2 19,-0.3 0.134 62.5 -85.1 -60.2 172.6 -11.4 -1.3 6.9 22 16 B G B -ab 4 40A 12 17,-1.0 19,-0.5 -19,-0.2 -17,-0.2 -0.392 48.2 -89.4 -75.2 159.5 -9.6 -2.0 3.6 23 17 B I - 0 0 95 -19,-0.8 -16,-2.9 17,-0.2 17,-0.3 -0.414 59.4 -91.5 -60.2 141.5 -6.4 -4.1 3.2 24 18 B A - 0 0 52 -18,-0.2 18,-0.2 16,-0.1 -1,-0.1 -0.171 47.8 -88.6 -61.4 151.6 -3.3 -1.8 3.4 25 19 B G - 0 0 9 16,-2.7 19,-0.5 -19,-0.1 2,-0.4 -0.286 42.0-113.5 -65.2 137.7 -1.7 -0.2 0.4 26 20 B Q - 0 0 108 -19,-0.5 -16,-2.9 17,-0.2 17,-0.2 -0.632 35.4-113.0 -81.9 124.8 0.9 -2.1 -1.5 27 21 B R - 0 0 197 -2,-0.4 18,-0.2 -18,-0.2 -15,-0.1 -0.065 33.3-102.6 -55.2 153.6 4.5 -0.7 -1.3 28 22 B G - 0 0 10 -17,-1.0 19,-0.3 16,-0.9 2,-0.3 -0.112 43.2 -79.4 -80.9 173.6 6.3 0.8 -4.4 29 23 B V - 0 0 112 -19,-0.2 -16,-1.3 17,-0.2 17,-0.2 -0.611 44.2-118.9 -93.4 131.6 9.1 -0.7 -6.5 30 24 B V - 0 0 83 -2,-0.3 18,-0.2 -18,-0.2 -1,-0.1 0.015 16.5-133.6 -60.4 160.0 12.8 -0.8 -5.6 31 25 B G - 0 0 26 -17,-1.6 -1,-0.1 16,-0.7 -17,-0.1 0.370 23.8-129.9 -87.8-136.7 15.9 0.8 -7.2 32 26 B L 0 0 111 18,-0.1 -16,-1.3 -16,-0.0 18,-0.1 -0.965 360.0 360.0-170.7 160.8 19.3 -0.9 -8.0 33 27 B P 0 0 131 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.569 360.0 360.0 -86.3 360.0 23.1 -0.7 -7.8 34 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 35 11 C P 0 0 144 0, 0.0 -16,-0.6 0, 0.0 -31,-0.1 0.000 360.0 360.0 360.0 163.9 -21.1 -0.6 2.7 36 12 C P - 0 0 52 0, 0.0 -17,-1.3 0, 0.0 -32,-0.2 0.495 360.0 -36.8 -73.2-130.1 -18.2 -3.0 3.5 37 13 C G - 0 0 7 -19,-0.2 -32,-0.4 -16,-0.1 -16,-0.2 -0.504 58.3-125.5 -82.3 168.2 -15.1 -0.9 4.6 38 14 C P S S- 0 0 100 0, 0.0 2,-0.2 0, 0.0 -33,-0.1 0.909 71.6 -43.2 -75.0 -44.8 -14.5 2.6 3.0 39 15 C Q - 0 0 58 -35,-0.1 -17,-1.0 -17,-0.0 -33,-0.2 -0.846 58.3-107.6 166.8 137.4 -10.8 2.2 1.9 40 16 C G B -b 22 0A 2 -35,-2.2 -32,-0.5 -17,-0.3 -17,-0.2 -0.527 49.8 -80.1 -83.4 160.0 -7.6 0.7 3.3 41 17 C I - 0 0 108 -19,-0.5 -16,-2.7 -34,-0.2 -34,-0.2 -0.288 55.2 -94.8 -61.7 143.7 -4.6 2.8 4.5 42 18 C A - 0 0 50 -35,-0.2 -33,-0.1 -18,-0.2 -1,-0.1 -0.209 44.2-104.5 -56.9 148.1 -2.1 4.2 1.9 43 19 C G - 0 0 14 -35,-1.9 -32,-0.5 -17,-0.2 -17,-0.2 -0.397 29.1-131.8 -77.9 149.4 1.0 2.2 1.1 44 20 C Q - 0 0 133 -19,-0.5 -16,-0.9 -34,-0.2 -1,-0.1 -0.230 41.6 -63.7 -90.8-177.8 4.5 3.2 2.4 45 21 C R - 0 0 160 -18,-0.2 -33,-0.2 -35,-0.2 -1,-0.2 -0.163 46.5-111.4 -67.2 164.5 7.7 3.5 0.4 46 22 C G - 0 0 4 -35,-1.3 -32,-0.4 -17,-0.2 -17,-0.2 -0.398 49.9 -74.8 -79.9 165.6 9.7 0.8 -1.5 47 23 C V - 0 0 103 -19,-0.3 -16,-0.7 -34,-0.2 -1,-0.1 -0.296 50.3-127.9 -64.1 145.0 13.1 -0.5 -0.3 48 24 C V - 0 0 71 -35,-0.2 -32,-0.2 1,-0.2 -1,-0.1 -0.020 40.1 -58.9 -79.8-171.7 16.2 1.8 -1.1 49 25 C G 0 0 22 -34,-1.6 -1,-0.2 1,-0.1 -33,-0.1 0.110 360.0 360.0 -64.1 179.4 19.5 1.1 -2.8 50 26 C L 0 0 180 -18,-0.1 -1,-0.1 -34,-0.0 -18,-0.1 -0.479 360.0 360.0 -96.0 360.0 22.1 -1.5 -1.8