==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FLUORESCENT PROTEIN 06-MAY-09 2WHU . COMPND 2 MOLECULE: LARGE STOKES SHIFT FLUORESCENT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MONTIPORA SP. 20; . AUTHOR S.VIOLOT,P.CARPENTIER,L.BLANCHOIN,D.BOURGEOIS . 860 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37264.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 616 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 383 44.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 1.3 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 0.1 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 . 78 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 3 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 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 5 4 1 7 3 5 3 6 4 8 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 2 0 0 0 0 0 0 0 1 0 2 1 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 2 A S 0 0 148 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.2 18.8 -11.1 5.5 2 3 A V + 0 0 82 1,-0.2 2,-0.5 78,-0.1 0, 0.0 0.754 360.0 38.2 -59.4 -35.8 20.7 -8.1 4.1 3 4 A I S S- 0 0 7 77,-0.1 -1,-0.2 4,-0.0 106,-0.1 -0.951 85.0-151.5-118.7 110.0 24.3 -9.4 5.1 4 5 A A - 0 0 26 -2,-0.5 29,-0.2 2,-0.1 3,-0.1 -0.027 27.1-107.6 -78.4-177.5 24.6 -13.2 4.5 5 6 A K S S+ 0 0 157 1,-0.3 2,-0.4 26,-0.1 28,-0.4 0.763 110.8 31.2 -82.1 -25.3 26.9 -15.6 6.4 6 7 A Q S S+ 0 0 78 25,-0.2 2,-0.3 26,-0.1 -1,-0.3 -0.998 79.3 160.9-136.3 130.3 29.0 -15.9 3.4 7 8 A M E -A 30 0A 2 23,-2.3 23,-2.0 -2,-0.4 2,-0.2 -0.905 24.1-144.2-143.3 165.6 29.6 -13.1 0.9 8 9 A T E -Ab 29 110A 64 101,-2.8 103,-1.5 -2,-0.3 21,-0.3 -0.660 14.9-167.3-120.1 178.8 31.8 -11.8 -1.8 9 10 A Y E -Ab 28 111A 4 19,-2.1 19,-2.8 101,-0.3 2,-0.3 -0.971 15.7-138.9-163.2 165.4 32.9 -8.3 -2.9 10 11 A K E -Ab 27 112A 37 101,-1.8 103,-2.4 -2,-0.3 2,-0.4 -0.967 18.3-160.1-130.3 138.7 34.6 -6.3 -5.7 11 12 A V E -Ab 26 113A 0 15,-2.4 15,-2.0 -2,-0.3 2,-0.4 -0.984 5.5-166.7-130.0 137.2 37.1 -3.5 -5.0 12 13 A Y E +Ab 25 114A 10 101,-2.3 103,-3.5 -2,-0.4 2,-0.4 -0.991 16.1 177.1-130.0 119.8 38.2 -0.8 -7.4 13 14 A M E +Ab 24 115A 0 11,-3.0 11,-1.7 -2,-0.4 2,-0.3 -0.940 9.1 156.1-130.4 145.0 41.2 1.3 -6.5 14 15 A S E +Ab 23 116A 9 101,-1.1 103,-2.2 -2,-0.4 2,-0.3 -0.969 14.7 117.2-163.0 154.8 43.2 4.1 -8.1 15 16 A G E -Ab 22 117A 9 7,-1.4 7,-2.1 -2,-0.3 2,-0.3 -0.978 47.6 -91.7 170.6-161.0 45.4 6.8 -7.0 16 17 A T E -Ab 21 118A 53 101,-2.5 103,-1.4 -2,-0.3 2,-0.4 -0.969 22.2-172.6-149.3 143.7 48.8 8.3 -7.1 17 18 A V E > S-Ab 20 119A 2 3,-1.5 3,-2.8 -2,-0.3 103,-0.2 -0.967 78.9 -17.4-151.8 117.0 51.8 7.9 -4.9 18 19 A N T 3 S- 0 0 61 101,-2.5 102,-0.1 -2,-0.4 3,-0.1 0.828 131.4 -49.7 48.0 39.2 54.8 10.0 -5.4 19 20 A G T 3 S+ 0 0 67 100,-0.4 2,-0.3 1,-0.3 -1,-0.3 0.045 109.9 123.2 95.8 -28.9 53.6 10.9 -8.8 20 21 A H E < -A 17 0A 59 -3,-2.8 -3,-1.5 1,-0.0 2,-0.3 -0.539 48.5-151.1 -80.8 129.7 52.9 7.3 -10.0 21 22 A Y E +A 16 0A 88 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.788 26.9 153.0 -97.6 142.3 49.3 6.6 -11.2 22 23 A F E -A 15 0A 0 -7,-2.1 -7,-1.4 -2,-0.3 2,-0.3 -0.962 27.8-148.4-156.3 169.0 47.8 3.0 -10.9 23 24 A E E -AC 14 45A 25 22,-1.9 22,-2.0 -2,-0.3 2,-0.4 -0.980 9.2-171.1-151.9 156.4 44.6 1.0 -10.6 24 25 A V E -A 13 0A 0 -11,-1.7 -11,-3.0 -2,-0.3 2,-0.4 -0.961 3.5-165.4-153.6 128.1 43.9 -2.3 -8.9 25 26 A E E -AC 12 42A 57 17,-2.0 17,-3.5 -2,-0.4 2,-0.3 -0.977 13.6-173.5-124.7 141.7 40.8 -4.4 -9.0 26 27 A G E -AC 11 41A 0 -15,-2.0 -15,-2.4 -2,-0.4 2,-0.4 -0.986 21.5-147.5-140.9 146.4 40.1 -7.2 -6.6 27 28 A D E -AC 10 40A 92 13,-2.1 13,-3.2 -2,-0.3 2,-0.3 -0.923 31.8-179.4-108.6 135.4 37.6 -10.0 -5.9 28 29 A G E +AC 9 39A 7 -19,-2.8 -19,-2.1 -2,-0.4 2,-0.3 -0.865 14.5 179.3-143.2 168.0 37.1 -10.8 -2.3 29 30 A K E +AC 8 38A 107 9,-2.1 9,-2.1 -21,-0.3 2,-0.3 -0.953 14.5 127.1-172.6 140.2 35.2 -13.1 0.0 30 31 A G E -AC 7 37A 7 -23,-2.0 -23,-2.3 -2,-0.3 7,-0.2 -0.966 56.2 -81.6-175.8-169.1 34.6 -14.0 3.7 31 32 A K E >>> - C 0 36A 91 5,-1.6 3,-2.3 -2,-0.3 4,-1.4 -0.919 31.4-159.2-121.3 102.2 32.1 -14.5 6.5 32 33 A P T 345S+ 0 0 0 0, 0.0 34,-0.5 0, 0.0 -1,-0.1 0.672 92.8 53.5 -58.9 -21.1 31.2 -11.1 7.9 33 34 A Y T 345S+ 0 0 100 -28,-0.4 -28,-0.1 -29,-0.2 32,-0.1 0.655 109.7 48.6 -89.6 -14.8 30.1 -12.7 11.1 34 35 A E T <45S- 0 0 70 -3,-2.3 33,-0.3 -29,-0.2 176,-0.2 0.744 105.5-123.8 -91.4 -24.5 33.4 -14.4 11.5 35 36 A G T <5 + 0 0 0 -4,-1.4 175,-1.3 1,-0.3 2,-0.4 0.678 69.1 130.0 85.6 22.9 35.6 -11.4 10.9 36 37 A E E < +CD 31 209A 92 -5,-1.3 -5,-1.6 173,-0.2 2,-0.3 -0.926 23.2 145.0-121.7 138.7 37.3 -13.3 8.1 37 38 A Q E -CD 30 208A 14 171,-1.8 171,-2.9 -2,-0.4 2,-0.3 -0.975 22.3-165.0-158.2 154.7 38.1 -12.5 4.5 38 39 A T E -CD 29 207A 56 -9,-2.1 -9,-2.1 -2,-0.3 2,-0.3 -0.824 14.9-167.8-120.5 173.4 40.7 -13.0 1.7 39 40 A V E -CD 28 206A 4 167,-1.7 167,-1.7 -2,-0.3 2,-0.4 -0.976 13.8-142.3-159.5 147.4 40.8 -11.0 -1.5 40 41 A K E -CD 27 205A 125 -13,-3.2 -13,-2.1 -2,-0.3 2,-0.4 -0.985 22.1-161.3-117.2 128.7 42.7 -11.3 -4.8 41 42 A L E -CD 26 204A 3 163,-3.3 163,-1.2 -2,-0.4 2,-0.4 -0.863 12.4-167.1-113.0 135.8 44.1 -8.2 -6.5 42 43 A T E -CD 25 203A 79 -17,-3.5 -17,-2.0 -2,-0.4 2,-1.7 -0.935 24.4-133.6-110.7 140.0 45.2 -7.4 -10.1 43 44 A V E + 0 0 13 159,-2.1 4,-0.3 -2,-0.4 -19,-0.3 -0.725 27.6 179.2 -82.2 86.1 47.1 -4.3 -10.9 44 45 A T E + 0 0 63 -2,-1.7 2,-0.3 1,-0.2 -20,-0.2 0.585 64.5 23.1 -52.8 -16.4 45.0 -3.3 -13.9 45 46 A K E S+C 23 0A 107 -22,-2.0 -22,-1.9 -3,-0.1 -1,-0.2 -0.846 118.1 15.7-167.9 126.1 47.1 -0.1 -14.5 46 47 A G S S- 0 0 29 1,-0.3 -2,-0.1 -2,-0.3 -24,-0.0 0.490 85.5-174.3 88.9 5.1 50.5 1.3 -13.8 47 48 A G + 0 0 35 -4,-0.3 -1,-0.3 -24,-0.1 154,-0.1 -0.401 58.7 56.8 -73.7 145.7 52.0 -2.2 -12.9 48 49 A P S S- 0 0 75 0, 0.0 153,-0.1 0, 0.0 154,-0.1 0.600 88.1-140.1 -75.2 136.9 54.7 -2.8 -11.8 49 50 A L - 0 0 5 151,-0.4 -2,-0.1 152,-0.2 4,-0.1 -0.480 2.4-147.2 -60.4 133.7 54.1 -0.5 -8.8 50 51 A P S S+ 0 0 43 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.527 79.1 64.4 -77.6 -9.2 57.4 1.4 -8.0 51 52 A F S S- 0 0 2 1,-0.1 78,-0.2 79,-0.1 -2,-0.1 -0.855 99.3 -76.0-120.0 161.9 56.3 1.3 -4.3 52 53 A A > - 0 0 4 76,-2.1 3,-0.9 -2,-0.3 4,-0.4 -0.121 33.4-135.7 -47.6 132.7 55.7 -1.2 -1.5 53 54 A W G >> S+ 0 0 8 1,-0.2 3,-1.2 2,-0.1 4,-1.1 0.776 93.4 76.9 -57.1 -28.2 52.4 -3.1 -1.9 54 55 A D G 34 S+ 0 0 13 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.776 78.5 64.0 -68.3 -31.3 51.7 -2.6 1.8 55 56 A I G <4 S+ 0 0 0 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.1 0.841 110.3 43.4 -64.2 -26.2 50.6 1.0 1.8 56 57 A L T X4 S+ 0 0 0 -3,-1.2 3,-3.2 -4,-0.4 -1,-0.2 0.832 91.6 87.3 -77.4 -34.9 47.6 -0.2 -0.3 57 58 A S G >< S+ 0 0 3 -4,-1.1 3,-1.7 1,-0.3 -2,-0.1 0.811 90.2 44.0 -38.0 -61.2 46.8 -3.4 1.7 58 59 A P G 3 S+ 0 0 20 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.558 105.1 61.3 -75.6 4.8 44.5 -1.7 4.2 59 60 A Q G < 0 0 4 -3,-3.2 -2,-0.2 1,-0.2 -3,-0.1 0.335 360.0 360.0-101.0 22.7 42.7 0.3 1.7 60 61 A L < 0 0 10 -3,-1.7 -1,-0.2 -4,-0.2 -3,-0.1 0.435 360.0 360.0-124.1 360.0 41.6 -3.0 0.1 61 ! 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 62 65 A S > 0 0 17 0, 0.0 3,-1.2 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 96.4 36.6 -3.9 4.2 63 66 A I T 3 + 0 0 7 1,-0.2 3,-0.2 2,-0.0 14,-0.1 0.607 360.0 75.4 -61.6 -27.9 35.0 -3.4 7.6 64 67 A P T 3 S+ 0 0 0 0, 0.0 2,-1.4 0, 0.0 -1,-0.2 0.766 84.4 69.3 -62.9 -21.3 31.8 -5.4 7.3 65 68 A F S < S+ 0 0 0 -3,-1.2 2,-0.4 -30,-0.1 -32,-0.1 -0.466 76.2 115.8 -91.3 63.3 33.8 -8.6 7.7 66 69 A T - 0 0 0 -2,-1.4 2,-0.6 -34,-0.5 145,-0.2 -0.988 68.5-126.7-130.6 120.6 34.5 -7.7 11.3 67 70 A K B -e 211 0A 83 143,-2.5 145,-2.7 -2,-0.4 -34,-0.1 -0.555 30.0-171.9 -73.5 113.2 33.1 -9.9 14.1 68 71 A Y - 0 0 28 -2,-0.6 2,-0.2 143,-0.2 6,-0.1 -0.806 23.9-118.5-102.2 143.8 31.0 -7.9 16.6 69 72 A P > - 0 0 39 0, 0.0 3,-2.9 0, 0.0 144,-0.1 -0.602 30.4-111.8 -75.6 147.1 29.6 -9.2 19.8 70 73 A E T 3 S+ 0 0 210 1,-0.3 4,-0.1 -2,-0.2 -2,-0.0 0.704 115.6 61.5 -43.9 -26.3 25.9 -9.1 20.1 71 74 A D T 3 S+ 0 0 106 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.373 93.5 70.2 -93.6 8.3 26.2 -6.4 22.8 72 75 A I S < S- 0 0 11 -3,-2.9 2,-0.5 111,-0.1 140,-0.1 -0.994 88.9-115.1-123.9 129.8 27.9 -3.8 20.5 73 76 A P - 0 0 23 0, 0.0 2,-2.2 0, 0.0 3,-0.1 -0.495 22.5-140.2 -58.4 109.0 26.1 -2.0 17.7 74 77 A D >> - 0 0 21 -2,-0.5 4,-2.8 1,-0.2 3,-0.5 -0.432 22.3-177.6 -73.9 63.3 27.7 -3.1 14.4 75 78 A Y H 3> S+ 0 0 1 -2,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.738 78.5 56.5 -23.4 -43.2 27.6 0.3 12.8 76 79 A F H 34 S+ 0 0 0 2,-0.2 4,-0.3 1,-0.2 3,-0.3 0.966 111.3 36.6 -68.2 -56.3 29.0 -1.3 9.6 77 80 A K H X4 S+ 0 0 20 -3,-0.5 3,-1.9 1,-0.2 -2,-0.2 0.909 112.6 61.6 -61.1 -40.2 26.5 -4.0 9.1 78 81 A Q H 3< S+ 0 0 38 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.882 93.4 66.0 -53.0 -38.7 23.6 -1.6 10.2 79 82 A S T 3X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.3 3,-0.5 0.623 88.0 138.6 -66.8 -13.1 24.5 0.8 7.4 80 83 A F T <4 + 0 0 6 -3,-1.9 -78,-0.1 -4,-0.3 -77,-0.1 -0.422 48.3 22.3 -84.6 159.5 23.4 -1.6 4.7 81 84 A P T 4 S+ 0 0 54 0, 0.0 25,-0.4 0, 0.0 -1,-0.3 -0.999 135.1 38.9 -82.4 -5.5 21.9 -1.9 2.0 82 85 A E T 4 S- 0 0 83 -3,-0.5 -2,-0.3 1,-0.2 -3,-0.1 0.825 99.3-172.7 -69.3 -29.1 22.6 1.8 1.5 83 86 A G < - 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