==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FLUORESCENT PROTEIN 21-AUG-09 3IR8 . COMPND 2 MOLECULE: LARGE STOKES SHIFT FLUORESCENT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MONTIPORA SP. 20; . AUTHOR J.N.HENDERSON,M.F.OSBORN,N.KOON,R.GEPSHTEIN,D.HUPPERT, . 427 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 304 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 202 47.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 . 30 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 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 RESIDUES PER ALPHA HELIX . 2 0 0 0 0 0 0 0 0 2 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 2 0 0 4 0 2 2 4 4 4 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 2 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 3 A V 0 0 123 0, 0.0 2,-0.7 0, 0.0 75,-0.0 0.000 360.0 360.0 360.0 -74.1 26.7 20.6 24.1 2 4 A I - 0 0 18 77,-0.1 4,-0.1 4,-0.0 106,-0.1 -0.872 360.0-161.8-111.0 109.0 29.1 20.6 21.1 3 5 A A - 0 0 47 -2,-0.7 29,-0.2 2,-0.2 3,-0.0 -0.263 33.9-106.7 -83.1 167.7 29.1 17.4 19.2 4 6 A K S S+ 0 0 94 1,-0.2 2,-0.4 26,-0.1 28,-0.3 0.771 114.9 41.1 -60.7 -32.4 31.7 16.0 16.7 5 7 A Q S S+ 0 0 81 25,-0.2 2,-0.3 26,-0.1 -2,-0.2 -0.996 79.3 166.9-118.3 124.7 29.2 16.9 13.8 6 8 A M E -A 29 0A 3 23,-2.5 23,-2.2 -2,-0.4 2,-0.2 -0.916 19.0-153.6-131.0 162.5 27.3 20.2 14.1 7 9 A T E -Ab 28 109A 54 101,-2.9 103,-2.5 -2,-0.3 2,-0.3 -0.740 10.1-162.2-121.0 175.1 25.2 22.5 11.9 8 10 A Y E -Ab 27 110A 4 19,-2.0 19,-2.8 101,-0.3 2,-0.4 -0.992 15.0-145.4-154.0 163.8 24.5 26.2 11.8 9 11 A K E -Ab 26 111A 36 101,-2.3 103,-2.7 -2,-0.3 2,-0.4 -0.975 18.0-165.3-122.7 135.4 22.2 28.8 10.5 10 12 A V E -Ab 25 112A 0 15,-2.0 15,-2.7 -2,-0.4 2,-0.4 -0.995 6.3-172.8-121.1 137.8 23.5 32.2 9.5 11 13 A Y E -Ab 24 113A 85 101,-2.7 103,-2.7 -2,-0.4 2,-0.4 -0.992 12.8-178.3-125.0 126.9 21.3 35.3 8.9 12 14 A M E +Ab 23 114A 6 11,-2.9 11,-2.4 -2,-0.4 2,-0.3 -0.948 11.1 177.6-125.8 139.4 23.1 38.4 7.5 13 15 A S E +Ab 22 115A 29 101,-2.0 103,-1.8 -2,-0.4 2,-0.3 -0.981 20.7 142.0-129.1 155.5 21.9 41.9 6.7 14 16 A G E -Ab 21 116A 4 7,-2.1 7,-2.4 -2,-0.3 2,-0.4 -0.996 40.5-130.2-173.7 170.8 24.0 44.8 5.5 15 17 A T E -Ab 20 117A 51 101,-1.7 103,-2.9 -2,-0.3 2,-0.5 -0.990 19.9-176.3-135.0 128.8 24.6 47.8 3.3 16 18 A V E > S-Ab 19 118A 0 3,-1.9 3,-2.1 -2,-0.4 103,-0.2 -0.989 78.2 -15.9-130.4 125.0 27.8 48.2 1.2 17 19 A N T 3 S- 0 0 57 101,-2.5 -1,-0.2 -2,-0.5 102,-0.2 0.893 132.8 -51.3 47.6 41.2 28.3 51.5 -0.7 18 20 A G T 3 S+ 0 0 69 100,-0.5 2,-0.6 1,-0.2 -1,-0.3 0.366 109.5 125.6 83.2 -2.8 24.6 52.1 -0.1 19 21 A H E < -A 16 0A 60 -3,-2.1 -3,-1.9 30,-0.0 2,-0.3 -0.819 47.8-150.5 -94.9 119.9 23.3 48.8 -1.4 20 22 A Y E +A 15 0A 93 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.623 24.5 158.9 -87.3 141.6 21.1 46.8 1.0 21 23 A F E -A 14 0A 0 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.4 -0.985 27.5-147.5-153.1 165.8 20.9 43.1 1.1 22 24 A E E -AC 13 44A 62 22,-2.2 22,-1.5 -2,-0.3 21,-1.3 -0.987 13.4-169.9-135.2 143.6 20.0 40.0 3.2 23 25 A V E -AC 12 42A 4 -11,-2.4 -11,-2.9 -2,-0.4 2,-0.4 -0.987 5.4-163.3-132.7 139.8 21.6 36.6 3.1 24 26 A E E -AC 11 41A 72 17,-2.6 17,-2.5 -2,-0.3 2,-0.3 -0.989 15.6-174.1-122.5 137.6 20.5 33.3 4.7 25 27 A G E -AC 10 40A 0 -15,-2.7 -15,-2.0 -2,-0.4 2,-0.4 -0.948 21.7-155.0-134.5 152.1 22.9 30.3 5.1 26 28 A D E -AC 9 39A 88 13,-2.3 13,-2.7 -2,-0.3 2,-0.3 -0.999 26.7-178.9-122.9 124.8 22.9 26.7 6.2 27 29 A G E -AC 8 38A 8 -19,-2.8 -19,-2.0 -2,-0.4 2,-0.3 -0.766 11.7-178.0-120.6 166.4 26.3 25.3 7.4 28 30 A K E +AC 7 37A 119 9,-2.5 9,-2.4 -21,-0.3 2,-0.3 -0.984 16.7 130.8-158.8 156.7 27.8 22.1 8.7 29 31 A G E -AC 6 36A 16 -23,-2.2 -23,-2.5 -2,-0.3 7,-0.2 -0.996 55.4 -83.0 176.6-176.0 31.1 20.8 10.0 30 32 A K E >>> - C 0 35A 80 5,-2.1 3,-1.9 -2,-0.3 5,-1.5 -0.895 32.8-165.9-115.5 96.4 33.3 19.0 12.5 31 33 A P T 345S+ 0 0 0 0, 0.0 34,-0.3 0, 0.0 3,-0.2 0.808 87.3 50.8 -59.9 -31.9 34.1 21.6 15.3 32 34 A Y T 345S+ 0 0 112 -28,-0.3 -28,-0.1 1,-0.2 32,-0.1 0.528 112.3 47.5 -84.0 -5.2 37.0 19.5 16.8 33 35 A E T <45S- 0 0 89 -3,-1.9 33,-0.3 -29,-0.2 -1,-0.2 0.482 108.0-122.3-106.0 -9.2 38.7 19.1 13.4 34 36 A G T <5 + 0 0 0 -4,-1.0 175,-2.1 -3,-0.2 2,-0.4 0.710 68.4 132.8 78.1 23.8 38.4 22.8 12.5 35 37 A E E < +CD 30 208A 85 -5,-1.5 -5,-2.1 173,-0.2 2,-0.3 -0.891 21.5 147.6-115.7 137.2 36.4 21.9 9.3 36 38 A Q E -CD 29 207A 9 171,-2.1 171,-2.9 -2,-0.4 2,-0.3 -0.986 21.4-166.3-160.9 160.9 33.1 23.5 8.0 37 39 A T E -CD 28 206A 55 -9,-2.4 -9,-2.5 -2,-0.3 2,-0.3 -0.915 9.8-164.9-141.6 157.7 31.2 24.4 4.8 38 40 A V E -CD 27 205A 4 167,-2.1 167,-2.3 -2,-0.3 2,-0.4 -0.987 13.7-145.6-149.4 147.8 28.2 26.6 4.3 39 41 A K E -CD 26 204A 113 -13,-2.7 -13,-2.3 -2,-0.3 2,-0.3 -0.976 24.1-163.7-113.9 124.2 25.6 27.2 1.5 40 42 A L E -CD 25 203A 3 163,-3.4 163,-1.9 -2,-0.4 2,-0.4 -0.839 12.4-166.7-114.2 145.2 24.3 30.8 1.2 41 43 A T E -CD 24 202A 71 -17,-2.5 -17,-2.6 -2,-0.3 2,-0.9 -1.000 22.0-136.5-127.8 127.3 21.3 32.3 -0.6 42 44 A V E +C 23 0A 14 159,-2.8 -19,-0.3 -2,-0.4 4,-0.1 -0.780 27.5 179.0 -77.3 110.6 21.0 36.1 -1.2 43 45 A T E + 0 0 82 -21,-1.3 2,-0.3 -2,-0.9 -20,-0.2 0.627 64.3 20.6 -92.7 -16.8 17.2 36.5 -0.2 44 46 A K E S+C 22 0A 114 -22,-1.5 -22,-2.2 1,-0.0 -1,-0.2 -0.983 118.2 24.4-148.8 142.1 17.0 40.3 -0.8 45 47 A G S S- 0 0 26 -2,-0.3 -2,-0.1 1,-0.3 -22,-0.0 0.573 85.2-172.9 85.7 7.2 19.1 42.8 -2.9 46 48 A G + 0 0 40 -4,-0.1 -1,-0.3 2,-0.1 2,-0.1 -0.518 57.0 48.4 -81.1 154.7 20.5 40.3 -5.4 47 49 A P S S- 0 0 71 0, 0.0 153,-0.1 0, 0.0 154,-0.1 0.598 87.1-138.6 -75.6 144.8 22.4 40.4 -7.6 48 50 A L - 0 0 4 151,-0.6 4,-0.1 152,-0.2 -2,-0.1 -0.526 1.2-145.0 -70.2 138.6 25.0 42.1 -5.3 49 51 A P S S+ 0 0 47 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.088 77.5 59.9 -88.2 20.6 26.9 44.9 -7.1 50 52 A F S S- 0 0 3 79,-0.1 78,-0.2 80,-0.1 2,-0.1 -0.941 98.1 -70.8-147.0 164.9 30.1 44.1 -5.1 51 53 A A > - 0 0 3 76,-1.7 3,-1.5 -2,-0.3 4,-0.4 -0.322 30.5-140.3 -63.8 125.9 32.5 41.3 -4.6 52 54 A W G >> S+ 0 0 9 1,-0.2 3,-2.2 2,-0.2 4,-1.3 0.808 93.9 77.3 -47.5 -34.2 31.3 38.3 -2.5 53 55 A D G 34 S+ 0 0 16 1,-0.3 -1,-0.2 2,-0.2 82,-0.1 0.781 82.7 63.2 -60.1 -25.7 34.7 38.1 -0.8 54 56 A I G <4 S+ 0 0 0 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.808 110.2 39.9 -71.1 -18.2 34.0 41.0 1.4 55 57 A L T X4 S+ 0 0 0 -3,-2.2 3,-2.3 -4,-0.4 4,-0.5 0.727 93.9 84.6 -95.6 -19.6 31.1 39.0 3.0 56 58 A S G >< S+ 0 0 3 -4,-1.3 3,-1.1 1,-0.3 -2,-0.1 0.821 86.5 51.3 -60.4 -39.1 32.8 35.6 3.2 57 59 A P G 3 S+ 0 0 20 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.519 104.5 61.2 -76.5 0.3 34.7 36.0 6.5 58 60 A Q G < 0 0 4 -3,-2.3 -2,-0.2 1,-0.1 -3,-0.1 0.487 360.0 360.0-105.5 16.9 31.4 37.1 8.2 59 61 A L < 0 0 10 -3,-1.1 -1,-0.1 -4,-0.5 -3,-0.1 0.784 360.0 360.0-116.0 360.0 29.8 33.9 7.5 60 ! 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 61 65 A S > 0 0 17 0, 0.0 3,-1.8 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 66.8 31.9 30.7 12.7 62 66 A I T 3 + 0 0 5 1,-0.3 3,-0.3 2,-0.0 14,-0.2 0.702 360.0 79.5 -73.9 -14.9 34.8 30.4 15.1 63 67 A P T 3 S+ 0 0 0 0, 0.0 2,-1.1 0, 0.0 -1,-0.3 0.776 84.6 68.9 -59.3 -20.1 33.4 27.4 17.1 64 68 A F S < S+ 0 0 0 -3,-1.8 2,-0.4 -30,-0.1 145,-0.2 -0.512 75.0 115.2 -92.0 57.2 34.6 25.2 14.2 65 69 A T S S- 0 0 0 -2,-1.1 2,-0.7 -34,-0.3 145,-0.2 -1.000 70.9-122.2-125.9 128.7 38.2 25.9 15.0 66 70 A K B -e 210 0A 92 143,-2.5 145,-3.2 -2,-0.4 -34,-0.1 -0.636 32.3-171.3 -74.1 115.1 40.5 23.0 16.1 67 71 A Y - 0 0 26 -2,-0.7 6,-0.1 143,-0.2 145,-0.1 -0.894 22.2-124.9-107.9 125.4 41.9 23.9 19.6 68 72 A P > - 0 0 46 0, 0.0 3,-2.1 0, 0.0 144,-0.0 -0.432 31.5-107.2 -65.3 156.6 44.6 21.7 21.1 69 73 A E T 3 S+ 0 0 139 1,-0.3 4,-0.1 -2,-0.1 -2,-0.0 0.765 116.0 56.6 -59.7 -24.8 43.7 20.4 24.6 70 74 A D T 3 S+ 0 0 105 2,-0.1 -1,-0.3 1,-0.1 -3,-0.0 0.312 93.9 72.2 -93.4 6.0 46.2 22.8 26.3 71 75 A I S < S- 0 0 10 -3,-2.1 -1,-0.1 111,-0.1 140,-0.1 -0.978 90.4-119.9-116.2 118.2 44.8 26.0 24.9 72 76 A P - 0 0 42 0, 0.0 2,-1.0 0, 0.0 3,-0.1 -0.345 21.3-131.6 -57.5 137.0 41.4 27.0 26.4 73 77 A D > - 0 0 24 1,-0.2 4,-2.0 -4,-0.1 5,-0.2 -0.793 22.8-174.0 -96.2 96.5 38.7 27.2 23.7 74 78 A Y H > S+ 0 0 2 -2,-1.0 4,-0.7 1,-0.2 -1,-0.2 0.867 80.4 47.8 -58.7 -42.4 37.1 30.6 24.4 75 79 A F H >4 S+ 0 0 0 2,-0.2 3,-0.7 1,-0.2 4,-0.4 0.939 111.8 43.7 -72.1 -51.4 34.4 30.0 21.7 76 80 A K H >4 S+ 0 0 19 1,-0.2 3,-1.4 -14,-0.2 -2,-0.2 0.916 111.4 57.1 -62.8 -36.3 33.2 26.5 22.5 77 81 A Q H 3< S+ 0 0 69 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.748 92.7 69.5 -64.3 -26.0 33.1 27.3 26.3 78 82 A S T - G 0 167A 7 4,-2.3 3,-2.2 -2,-0.7 76,-0.2 -0.469 24.9-112.4 -77.2 156.7 41.2 48.5 3.5 92 96 A E T 3 S+ 0 0 88 74,-2.4 -1,-0.1 1,-0.3 75,-0.1 0.696 114.5 52.9 -67.5 -22.9 44.5 50.1 2.4 93 97 A D T 3 S- 0 0 78 73,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.312 125.3 -94.9 -92.6 6.8 42.7 52.7 0.2 94 98 A G S < S+ 0 0 46 -3,-2.2 -2,-0.1 1,-0.4 27,-0.1 0.363 78.9 138.7 101.8 -7.8 40.4 54.0 3.0 95 99 A A - 0 0 0 -5,-0.1 -4,-2.3 25,-0.1 -1,-0.4 -0.481 36.1-163.4 -66.0 145.4 37.3 51.8 2.3 96 100 A V E -FH 90 119A 50 23,-2.1 23,-2.1 -6,-0.2 2,-0.4 -1.000 16.8-171.4-133.0 137.7 35.9 50.6 5.7 97 101 A C E -FH 89 118A 0 -8,-2.4 -8,-2.7 -2,-0.4 2,-0.4 -0.992 6.2-163.2-119.9 140.7 33.5 47.8 6.7 98 102 A T E -FH 88 117A 68 19,-2.8 19,-2.4 -2,-0.4 2,-0.4 -0.961 10.9-170.6-118.3 142.6 32.2 47.4 10.3 99 103 A V E -FH 87 116A 1 -12,-2.8 -12,-2.7 -2,-0.4 2,-0.4 -0.965 9.1-170.8-136.6 137.2 30.6 44.1 11.3 100 104 A S E -FH 86 115A 39 15,-2.4 15,-2.6 -2,-0.4 2,-0.3 -0.995 8.8-171.1-130.5 141.8 28.7 42.9 14.3 101 105 A N E -FH 85 114A 11 -16,-2.7 -16,-1.6 -2,-0.4 2,-0.4 -0.967 17.2-163.3-131.7 145.6 27.6 39.4 15.3 102 106 A D E -FH 84 113A 51 11,-2.4 11,-2.6 -2,-0.3 2,-0.5 -0.999 18.2-167.1-117.0 131.7 25.4 37.6 17.8 103 107 A S E +FH 83 112A 0 -20,-2.9 -20,-1.5 -2,-0.4 2,-0.2 -0.977 17.0 153.9-128.1 128.6 26.1 33.8 18.2 104 108 A S E - 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