==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FLUORESCENT PROTEIN 28-SEP-11 3U0M . COMPND 2 MOLECULE: MRUBY; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTACMAEA QUADRICOLOR; . AUTHOR J.AKERBOOM,L.L.LOOGER,E.R.SCHREITER . 216 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10189.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 47.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 16 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 . 1 0 0 0 0 0 0 0 1 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 1 0 0 2 0 1 1 2 1 3 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 1 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 4 A L 0 0 122 0, 0.0 2,-0.8 0, 0.0 75,-0.0 0.000 360.0 360.0 360.0 -28.6 7.9 0.3 3.3 2 5 A I - 0 0 11 74,-0.1 4,-0.1 77,-0.1 2,-0.1 -0.887 360.0-164.4 -95.7 105.8 4.8 0.7 5.4 3 6 A K - 0 0 129 -2,-0.8 29,-0.2 2,-0.2 3,-0.1 -0.302 35.6-102.5 -86.3 173.8 2.7 -2.4 4.9 4 7 A E S S+ 0 0 144 1,-0.2 2,-0.5 26,-0.1 28,-0.2 0.806 117.0 41.9 -70.1 -24.9 -0.9 -3.1 5.7 5 8 A N S S+ 0 0 134 25,-0.2 2,-0.4 26,-0.1 -2,-0.2 -0.995 78.4 172.9-116.7 120.0 0.2 -5.1 8.7 6 9 A M E -A 29 0A 8 23,-2.3 23,-2.0 -2,-0.5 2,-0.3 -0.995 19.6-148.3-130.1 140.9 3.1 -3.5 10.7 7 10 A R E -A 28 0A 157 101,-0.5 103,-2.7 -2,-0.4 2,-0.3 -0.677 14.7-166.7 -95.6 157.7 4.7 -4.4 14.0 8 11 A M E -Ab 27 110A 2 19,-1.9 19,-2.4 -2,-0.3 2,-0.3 -0.978 8.5-166.6-141.7 152.1 6.3 -2.0 16.4 9 12 A K E -Ab 26 111A 108 101,-2.1 103,-3.0 -2,-0.3 2,-0.4 -0.972 12.3-168.3-137.0 149.1 8.5 -2.1 19.5 10 13 A V E -Ab 25 112A 5 15,-2.3 15,-2.3 -2,-0.3 2,-0.4 -0.987 20.0-163.8-143.4 142.2 9.2 0.5 22.0 11 14 A V E -Ab 24 113A 36 101,-2.1 103,-2.4 -2,-0.4 2,-0.4 -0.995 19.1-178.8-119.5 133.3 11.4 1.4 24.8 12 15 A L E +Ab 23 114A 0 11,-2.7 11,-3.4 -2,-0.4 2,-0.3 -0.991 9.2 164.4-134.9 128.9 10.2 4.2 27.1 13 16 A E E +Ab 22 115A 63 101,-2.5 103,-2.7 -2,-0.4 2,-0.3 -0.981 15.2 82.2-146.2 157.7 12.2 5.5 30.0 14 17 A G E -Ab 21 116A 2 7,-2.3 7,-3.0 -2,-0.3 2,-0.3 -0.987 57.7 -69.8 154.5-145.9 12.5 8.3 32.4 15 18 A S E -Ab 20 117A 15 101,-1.8 103,-2.8 -2,-0.3 2,-0.4 -0.989 16.6-159.1-147.7 152.3 11.0 9.6 35.7 16 19 A V E > S-Ab 19 118A 0 3,-1.6 3,-2.4 -2,-0.3 103,-0.2 -0.987 86.4 -13.3-130.8 129.0 8.0 11.2 37.1 17 20 A N T 3 S- 0 0 62 101,-2.6 102,-0.2 -2,-0.4 3,-0.1 0.871 132.2 -52.6 49.7 39.9 8.2 13.2 40.4 18 21 A G T 3 S+ 0 0 64 100,-0.6 2,-0.8 1,-0.2 -1,-0.3 0.300 108.0 128.6 80.6 -9.2 11.7 11.7 40.8 19 22 A H E < -A 16 0A 62 -3,-2.4 -3,-1.6 30,-0.0 2,-0.3 -0.725 50.1-146.1 -84.6 109.8 10.6 8.1 40.4 20 23 A Q E +A 15 0A 132 -2,-0.8 2,-0.3 -5,-0.2 -5,-0.3 -0.559 28.0 158.2 -78.5 141.2 12.8 6.4 37.8 21 24 A F E -A 14 0A 6 -7,-3.0 -7,-2.3 -2,-0.3 2,-0.3 -0.979 28.4-152.0-154.5 168.3 11.3 3.8 35.5 22 25 A K E -AC 13 44A 57 22,-2.2 21,-2.0 -2,-0.3 22,-1.9 -0.995 13.0-173.5-144.6 138.7 11.6 1.8 32.2 23 26 A C E -AC 12 42A 0 -11,-3.4 -11,-2.7 -2,-0.3 2,-0.4 -0.950 6.6-160.3-129.4 148.6 8.9 0.2 30.1 24 27 A T E -AC 11 41A 39 17,-2.3 17,-2.8 -2,-0.4 2,-0.3 -0.974 14.0-178.2-126.3 143.9 9.1 -2.0 27.0 25 28 A G E -AC 10 40A 8 -15,-2.3 -15,-2.3 -2,-0.4 2,-0.3 -0.953 12.8-175.3-139.1 153.3 6.2 -2.6 24.5 26 29 A E E +AC 9 39A 93 13,-2.1 13,-3.1 -2,-0.3 2,-0.3 -0.966 21.9 135.4-144.8 150.1 5.5 -4.5 21.4 27 30 A G E -AC 8 38A 1 -19,-2.4 -19,-1.9 -2,-0.3 2,-0.3 -0.894 31.7-129.3-164.9-168.6 2.4 -4.5 19.2 28 31 A E E +AC 7 37A 80 9,-1.8 9,-2.5 -21,-0.3 2,-0.3 -0.965 22.8 158.0-155.2 165.3 1.0 -4.4 15.8 29 32 A G E -AC 6 36A 14 -23,-2.0 -23,-2.3 -2,-0.3 7,-0.2 -0.979 44.1 -92.2-170.8-176.3 -1.6 -2.6 13.7 30 33 A N E >>> - C 0 35A 34 5,-1.9 3,-1.6 -2,-0.3 5,-1.5 -0.906 29.3-164.3-114.4 100.5 -2.9 -1.5 10.3 31 34 A P T 345S+ 0 0 0 0, 0.0 34,-0.4 0, 0.0 3,-0.2 0.781 87.1 51.8 -56.4 -29.3 -1.3 1.8 9.4 32 35 A Y T 345S+ 0 0 101 1,-0.2 -28,-0.1 -28,-0.2 32,-0.1 0.473 111.7 46.2 -86.2 -15.4 -3.8 2.5 6.7 33 36 A M T <45S- 0 0 93 -3,-1.6 33,-0.3 2,-0.2 -1,-0.2 0.427 109.5-121.8 -96.8 -5.1 -6.8 1.9 8.9 34 37 A G T <5 + 0 0 0 -4,-0.9 178,-2.4 31,-0.3 2,-0.4 0.724 67.3 128.4 70.1 29.1 -5.5 3.9 11.8 35 38 A T E < +CD 30 211A 57 -5,-1.5 -5,-1.9 176,-0.2 2,-0.3 -0.895 24.8 157.8-122.1 144.3 -5.5 1.1 14.3 36 39 A Q E -CD 29 210A 13 174,-1.5 174,-2.1 -2,-0.4 2,-0.3 -0.976 19.9-159.3-158.6 152.0 -3.0 -0.4 16.6 37 40 A T E -CD 28 209A 35 -9,-2.5 -9,-1.8 -2,-0.3 2,-0.4 -0.983 12.1-169.8-131.3 139.7 -2.6 -2.4 19.8 38 41 A M E -CD 27 208A 5 170,-2.7 170,-2.2 -2,-0.3 2,-0.5 -0.999 15.1-149.7-133.6 138.7 0.4 -2.5 22.1 39 42 A R E -CD 26 207A 68 -13,-3.1 -13,-2.1 -2,-0.4 2,-0.4 -0.927 25.5-168.0-105.4 122.6 1.3 -4.8 25.0 40 43 A I E -CD 25 206A 1 166,-3.4 166,-2.5 -2,-0.5 2,-0.4 -0.970 11.8-166.7-122.4 137.9 3.5 -2.9 27.5 41 44 A K E -CD 24 205A 115 -17,-2.8 -17,-2.3 -2,-0.4 2,-0.8 -0.946 21.4-136.4-119.1 135.0 5.5 -4.1 30.6 42 45 A V E +C 23 0A 12 162,-2.4 -19,-0.3 -2,-0.4 3,-0.1 -0.849 31.0 172.2 -82.6 113.6 7.0 -2.0 33.3 43 46 A I E + 0 0 78 -21,-2.0 2,-0.3 -2,-0.8 -20,-0.2 0.635 61.5 30.1-104.8 -20.1 10.4 -3.6 33.5 44 47 A E E S+C 22 0A 108 -22,-1.9 -22,-2.2 1,-0.0 -1,-0.3 -0.992 118.1 17.8-134.9 139.3 12.2 -1.2 36.0 45 48 A G S S- 0 0 32 -2,-0.3 -2,-0.1 1,-0.3 -22,-0.1 0.412 88.8-176.2 89.5 3.2 10.7 0.9 38.7 46 49 A G + 0 0 31 -24,-0.1 -1,-0.3 2,-0.1 2,-0.1 -0.475 55.5 49.2 -89.0 155.6 7.5 -0.8 39.1 47 50 A P S S- 0 0 76 0, 0.0 156,-0.1 0, 0.0 -1,-0.1 0.421 88.4-140.7 -72.8 136.0 5.0 -0.7 40.6 48 51 A L - 0 0 9 154,-0.4 4,-0.1 1,-0.1 -2,-0.1 -0.470 5.4-139.1 -68.4 140.4 4.8 2.9 39.5 49 52 A P S S+ 0 0 50 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.013 82.4 58.5 -90.2 24.2 3.6 5.3 42.2 50 53 A F S S- 0 0 0 79,-0.1 2,-0.3 80,-0.1 78,-0.2 -0.970 98.3 -77.5-146.8 163.5 1.6 7.2 39.5 51 54 A A > - 0 0 1 76,-1.8 3,-1.7 -2,-0.3 4,-0.3 -0.379 28.2-144.2 -60.5 125.2 -1.2 6.6 37.0 52 55 A F T >> S+ 0 0 0 1,-0.3 3,-2.2 -2,-0.3 4,-1.0 0.766 91.4 83.3 -58.1 -25.8 0.0 4.9 33.9 53 56 A D H 3> S+ 0 0 8 1,-0.3 4,-0.6 2,-0.2 3,-0.5 0.801 81.9 62.0 -48.3 -35.7 -2.4 7.0 32.0 54 57 A I H <4 S+ 0 0 1 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.731 109.6 39.6 -68.4 -22.0 0.2 9.8 32.0 55 58 A L H X4 S+ 0 0 2 -3,-2.2 3,-2.0 -4,-0.3 4,-0.4 0.570 93.8 87.5 -91.8 -15.7 2.5 7.6 30.0 56 59 A A H >< S+ 0 0 4 -4,-1.0 3,-1.1 -3,-0.5 -2,-0.1 0.867 84.0 53.3 -62.9 -32.9 -0.1 6.1 27.7 57 60 A T T 3< S+ 0 0 33 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.455 101.4 63.0 -81.7 3.7 -0.0 8.9 25.0 58 61 A S T < 0 0 5 -3,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.518 360.0 360.0-102.5 -9.6 3.8 8.5 24.6 59 62 A F < 0 0 8 -3,-1.1 -2,-0.1 -4,-0.4 -1,-0.1 0.748 360.0 360.0 -84.7 360.0 3.8 4.9 23.4 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 66 A S > 0 0 13 0, 0.0 3,-1.6 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 69.2 2.6 6.1 17.3 62 67 A R T 3 + 0 0 16 1,-0.3 3,-0.2 13,-0.0 13,-0.2 0.539 360.0 77.7 -73.9 -11.2 1.8 8.4 14.4 63 68 A T T 3 S+ 0 0 0 1,-0.2 2,-1.1 12,-0.1 -1,-0.3 0.739 86.1 69.4 -64.0 -27.4 2.5 6.0 11.5 64 69 A F < + 0 0 0 -3,-1.6 2,-0.4 -30,-0.1 148,-0.3 -0.594 68.5 119.8 -97.9 58.3 -0.9 4.4 12.3 65 70 A I - 0 0 2 -2,-1.1 2,-0.8 -34,-0.4 -31,-0.3 -1.000 63.5-128.0-117.4 131.8 -3.3 7.2 11.2 66 71 A K B -e 213 0A 80 146,-2.3 148,-2.8 -2,-0.4 -34,-0.1 -0.734 32.6-171.4 -77.9 107.3 -5.8 6.6 8.6 67 72 A Y - 0 0 28 -2,-0.8 6,-0.1 146,-0.2 148,-0.1 -0.903 16.2-129.9-102.9 131.5 -5.3 9.5 6.1 68 73 A P > - 0 0 43 0, 0.0 3,-2.0 0, 0.0 2,-0.3 -0.397 33.1 -94.4 -69.0 153.7 -7.7 10.2 3.2 69 74 A K T 3 S+ 0 0 212 1,-0.3 0, 0.0 -2,-0.0 0, 0.0 -0.525 119.0 45.5 -59.0 123.3 -6.6 10.6 -0.4 70 75 A G T 3 S+ 0 0 62 -2,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.317 96.9 77.1 106.7 -9.3 -6.3 14.3 -0.5 71 76 A I S < S- 0 0 11 -3,-2.0 143,-0.1 114,-0.1 117,-0.0 -0.899 83.4-128.4-122.7 113.5 -4.5 14.9 2.8 72 77 A P - 0 0 28 0, 0.0 2,-0.9 0, 0.0 -3,-0.0 -0.196 15.7-129.8 -56.5 144.4 -0.8 14.1 2.5 73 78 A D > - 0 0 22 1,-0.2 4,-1.9 -6,-0.1 5,-0.1 -0.822 22.5-174.9-105.3 93.3 0.5 11.7 5.1 74 79 A F H > S+ 0 0 0 -2,-0.9 4,-0.8 1,-0.2 -1,-0.2 0.866 80.0 50.2 -55.5 -41.6 3.7 13.3 6.6 75 80 A F H >4 S+ 0 0 0 2,-0.2 3,-0.9 -13,-0.2 4,-0.4 0.946 111.1 44.7 -72.2 -50.1 4.5 10.3 8.8 76 81 A K H >4 S+ 0 0 23 1,-0.2 3,-1.1 -14,-0.2 -1,-0.2 0.908 111.0 55.2 -64.2 -33.2 4.3 7.5 6.3 77 82 A Q H 3< S+ 0 0 60 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.691 92.8 73.4 -69.5 -16.9 6.2 9.6 3.7 78 83 A S T - G 0 167A 12 4,-2.8 3,-2.0 -2,-0.5 76,-0.2 -0.734 23.8-117.8-105.5 147.2 -1.8 19.4 33.4 92 97 A E T 3 S+ 0 0 133 74,-2.7 75,-0.1 -2,-0.3 -1,-0.1 0.728 111.4 50.2 -56.4 -27.0 -4.3 21.7 35.1 93 98 A D T 3 S- 0 0 51 73,-0.2 -1,-0.3 2,-0.1 32,-0.1 0.303 128.8 -82.9-102.6 10.1 -3.2 20.9 38.6 94 99 A G S < S+ 0 0 37 -3,-2.0 -2,-0.1 1,-0.3 27,-0.1 0.117 80.5 129.5 117.6 -23.8 0.6 21.5 38.0 95 100 A G - 0 0 0 -5,-0.1 -4,-2.8 23,-0.1 2,-0.4 -0.400 32.6-168.2 -65.4 143.4 2.3 18.5 36.5 96 101 A V E -FH 90 119A 31 23,-2.1 23,-2.6 -6,-0.2 2,-0.4 -0.996 0.9-168.5-129.2 132.7 4.5 19.0 33.4 97 102 A I E -FH 89 118A 4 -8,-2.3 -8,-3.4 -2,-0.4 2,-0.5 -0.998 3.6-162.6-126.5 125.7 5.8 16.1 31.3 98 103 A T E -FH 88 117A 69 19,-2.6 19,-2.4 -2,-0.4 2,-0.4 -0.921 12.0-175.2-105.7 131.2 8.4 16.5 28.7 99 104 A V E -FH 87 116A 1 -12,-2.8 -12,-2.6 -2,-0.5 2,-0.4 -0.970 13.9-171.9-133.1 134.6 8.8 13.7 26.1 100 105 A M E -FH 86 115A 79 15,-2.1 15,-2.8 -2,-0.4 2,-0.4 -0.999 17.4-174.2-122.2 129.0 11.3 13.2 23.3 101 106 A Q E -FH 85 114A 2 -16,-3.0 -16,-2.1 -2,-0.4 2,-0.5 -0.951 16.2-159.4-132.1 141.4 10.7 10.4 20.9 102 107 A D E -FH 84 113A 45 11,-2.6 11,-2.1 -2,-0.4 2,-0.5 -0.982 7.6-163.4-116.1 134.9 12.4 8.8 18.0 103 108 A T E +FH 83 112A 0 -20,-2.6 -20,-0.8 -2,-0.5 2,-0.3 -0.961 19.7 160.3-121.3 120.2 10.7 6.7 15.4 104 109 A S E - 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0 0 4 -25,-0.1 -1,-0.2 -27,-0.1 -27,-0.1 -0.648 53.8-106.9 -72.8 125.5 2.5 16.4 39.9 122 127 A P > - 0 0 36 0, 0.0 3,-2.0 0, 0.0 6,-0.5 -0.295 20.1-133.4 -65.2 137.0 0.7 17.2 43.2 123 128 A S T 3 S+ 0 0 91 1,-0.3 -2,-0.0 5,-0.1 -3,-0.0 0.790 106.8 40.9 -57.4 -33.6 1.3 14.4 45.7 124 129 A N T 3 S+ 0 0 129 4,-0.1 -1,-0.3 5,-0.1 -3,-0.0 0.350 96.4 108.0 -91.7 -1.1 -2.4 14.3 46.7 125 130 A G S <> S- 0 0 11 -3,-2.0 4,-1.8 1,-0.1 5,-0.2 -0.236 86.5 -99.3 -76.0 169.3 -3.7 14.7 43.1 126 131 A A T 4>S+ 0 0 17 1,-0.2 5,-2.4 2,-0.2 4,-0.4 0.804 117.9 56.0 -62.4 -34.5 -5.3 12.0 41.0 127 132 A V T >45S+ 0 0 1 1,-0.2 -76,-1.8 3,-0.2 3,-1.3 0.989 113.8 36.3 -61.9 -56.3 -2.1 11.2 39.1 128 133 A M T 345S+ 0 0 28 -6,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.704 119.0 50.7 -70.6 -21.9 0.1 10.5 42.0 129 134 A Q T 3<5S- 0 0 98 -4,-1.8 -1,-0.3 -78,-0.0 -2,-0.2 0.318 108.9-123.5 -94.9 5.4 -2.8 8.8 44.0 130 135 A K T < 5 + 0 0 77 -3,-1.3 -3,-0.2 -4,-0.4 -4,-0.1 0.907 68.1 135.2 52.0 48.7 -3.7 6.6 41.0 131 136 A K < + 0 0 96 -5,-2.4 29,-2.5 -6,-0.1 2,-0.2 -0.140 32.2 114.8-112.9 33.4 -7.2 7.7 40.8 132 137 A T E -I 159 0A 19 -6,-0.3 27,-0.3 27,-0.2 -80,-0.1 -0.671 46.0-162.2-103.9 167.6 -7.5 8.2 37.0 133 138 A K E - 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