==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE SUBSTRATE 10-OCT-11 3U4S . COMPND 2 MOLECULE: LYSINE-SPECIFIC DEMETHYLASE 4A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.MA,M.A.MCDONOUGH,C.J.SCHOFIELD . 710 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30109.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 138 19.4 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 41 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 18.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 2 4 5 1 2 2 4 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 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 PARALLEL BRIDGES PER LADDER . 1 4 6 4 4 2 0 4 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 . 2 0 4 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 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 8 A L 0 0 141 0, 0.0 33,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 131.4 -0.0 -40.1 -5.2 2 9 A N > + 0 0 20 1,-0.1 3,-1.4 2,-0.1 6,-0.0 0.969 360.0 173.3 51.0 58.0 3.7 -39.2 -5.0 3 10 A P T 3 S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 28,-0.0 0.711 75.4 58.5 -68.0 -20.9 3.4 -37.2 -8.2 4 11 A S T 3 S- 0 0 78 2,-0.1 3,-0.1 1,-0.0 -2,-0.1 0.632 98.6-142.7 -78.3 -13.4 6.9 -35.9 -7.7 5 12 A A < + 0 0 7 -3,-1.4 2,-0.2 1,-0.2 -3,-0.1 0.846 42.3 161.3 51.4 35.1 8.1 -39.6 -7.7 6 13 A R - 0 0 134 1,-0.1 29,-0.3 30,-0.0 -1,-0.2 -0.604 50.6 -89.8 -83.0 149.5 10.6 -38.6 -5.0 7 14 A I - 0 0 22 -2,-0.2 2,-0.3 28,-0.2 31,-0.2 -0.391 46.8-148.9 -62.4 127.4 12.1 -41.4 -2.8 8 15 A M E -a 38 0A 50 29,-0.6 31,-2.5 24,-0.3 2,-0.4 -0.741 5.3-149.1-102.2 146.1 10.0 -42.0 0.3 9 16 A T E -a 39 0A 56 -2,-0.3 2,-0.4 29,-0.2 31,-0.2 -0.927 14.2-159.0-110.7 140.6 11.1 -43.1 3.7 10 17 A F E -a 40 0A 14 29,-1.8 31,-3.6 -2,-0.4 17,-0.0 -0.945 16.5-166.6-126.6 139.7 8.8 -45.2 6.0 11 18 A Y - 0 0 168 -2,-0.4 2,-0.1 29,-0.2 29,-0.1 -0.689 22.1-170.9-121.2 77.3 8.7 -45.8 9.7 12 19 A P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 -0.378 20.3-123.9 -70.6 143.9 6.4 -48.8 10.2 13 20 A T > - 0 0 76 1,-0.1 4,-3.0 30,-0.1 3,-0.3 -0.429 34.1-102.2 -72.9 160.3 5.3 -49.9 13.7 14 21 A M H > S+ 0 0 54 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.830 123.7 56.6 -54.4 -35.2 6.0 -53.4 14.7 15 22 A E H 4 S+ 0 0 87 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.931 114.9 35.8 -63.2 -47.1 2.3 -54.3 14.0 16 23 A E H >4 S+ 0 0 73 -3,-0.3 3,-0.6 1,-0.2 -2,-0.2 0.828 114.1 59.8 -72.1 -33.0 2.6 -53.0 10.4 17 24 A F H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.716 88.2 75.9 -69.4 -23.1 6.1 -54.3 10.1 18 25 A R T 3< S+ 0 0 37 -4,-1.2 2,-0.8 -3,-0.3 123,-0.3 0.852 87.7 56.9 -62.6 -42.5 5.1 -57.9 10.8 19 26 A N <> - 0 0 75 -3,-0.6 4,-1.9 -4,-0.4 5,-0.2 -0.832 67.3-168.9 -98.8 110.4 3.6 -58.8 7.5 20 27 A F H > S+ 0 0 11 -2,-0.8 4,-1.9 2,-0.2 5,-0.2 0.965 83.1 41.5 -63.9 -58.9 6.1 -58.2 4.7 21 28 A S H > S+ 0 0 53 125,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.914 113.4 55.1 -58.2 -44.7 4.0 -58.5 1.6 22 29 A R H > S+ 0 0 118 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.904 107.8 48.8 -56.1 -44.5 1.2 -56.5 3.1 23 30 A Y H X S+ 0 0 11 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.849 106.4 55.3 -69.6 -33.6 3.5 -53.6 4.0 24 31 A I H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.912 108.1 50.4 -61.6 -41.6 5.0 -53.5 0.5 25 32 A A H X S+ 0 0 7 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.911 109.3 52.6 -61.7 -41.3 1.4 -53.1 -0.8 26 33 A Y H X S+ 0 0 90 -4,-2.0 4,-1.4 2,-0.2 3,-0.3 0.956 107.6 48.0 -59.8 -51.3 0.9 -50.3 1.7 27 34 A I H <>S+ 0 0 0 -4,-2.8 5,-2.5 1,-0.3 -1,-0.2 0.843 110.7 53.9 -64.1 -25.6 4.0 -48.3 0.6 28 35 A E H ><5S+ 0 0 0 -4,-1.7 3,-1.9 -5,-0.2 -1,-0.3 0.879 100.9 58.6 -72.8 -32.9 2.8 -48.8 -2.9 29 36 A S H 3<5S+ 0 0 30 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.834 105.5 51.6 -61.5 -28.6 -0.6 -47.4 -2.0 30 37 A Q T 3<5S- 0 0 67 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.333 123.8-106.3 -88.9 5.5 1.3 -44.2 -0.9 31 38 A G T X 5S+ 0 0 2 -3,-1.9 3,-1.4 -5,-0.2 4,-0.5 0.588 73.8 141.0 83.9 10.7 3.1 -44.0 -4.3 32 39 A A G > < + 0 0 0 -5,-2.5 3,-1.6 1,-0.3 5,-0.4 0.896 64.7 61.0 -50.0 -44.9 6.5 -45.2 -3.0 33 40 A H G > S+ 0 0 3 1,-0.3 3,-1.4 -6,-0.2 -1,-0.3 0.715 85.3 76.0 -61.7 -24.9 7.2 -47.3 -6.2 34 41 A R G < S+ 0 0 38 -3,-1.4 173,-0.4 1,-0.3 -1,-0.3 0.828 92.6 53.6 -59.2 -32.8 7.1 -44.3 -8.5 35 42 A A G < S- 0 0 2 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.683 106.4-128.7 -72.6 -19.9 10.6 -43.2 -7.3 36 43 A G S < S+ 0 0 0 -3,-1.4 228,-2.0 -4,-0.4 2,-0.3 0.219 85.6 54.6 89.8 -14.6 12.0 -46.7 -8.1 37 44 A L E - B 0 263A 0 -5,-0.4 -29,-0.6 226,-0.2 2,-0.3 -0.996 61.1-177.4-151.5 141.3 13.4 -46.9 -4.6 38 45 A A E -aB 8 262A 0 224,-2.6 224,-3.2 -2,-0.3 2,-0.4 -0.993 17.0-138.3-142.5 150.2 12.1 -46.6 -1.1 39 46 A K E -aB 9 261A 18 -31,-2.5 -29,-1.8 -2,-0.3 2,-0.4 -0.849 13.0-167.2-106.0 145.2 13.6 -46.7 2.4 40 47 A V E -aB 10 260A 0 220,-2.8 220,-2.7 -2,-0.4 -29,-0.2 -0.975 7.7-155.7-132.3 119.4 12.0 -48.5 5.3 41 48 A V - 0 0 27 -31,-3.6 218,-0.1 -2,-0.4 3,-0.1 -0.847 21.8-134.5 -95.2 119.5 13.2 -48.0 8.9 42 49 A P - 0 0 11 0, 0.0 -28,-0.1 0, 0.0 -29,-0.1 -0.246 36.2 -79.9 -65.6 156.1 12.4 -50.9 11.1 43 50 A P > - 0 0 12 0, 0.0 3,-2.5 0, 0.0 -30,-0.1 -0.364 42.4-123.8 -48.9 134.4 10.9 -50.5 14.6 44 51 A K T 3 S+ 0 0 107 1,-0.3 0, 0.0 -3,-0.1 0, 0.0 0.718 111.5 62.2 -58.9 -23.2 13.8 -49.7 16.9 45 52 A E T 3 S+ 0 0 143 2,-0.0 2,-0.4 0, 0.0 -1,-0.3 0.577 90.2 92.8 -77.0 -10.7 12.9 -52.7 19.0 46 53 A W < + 0 0 17 -3,-2.5 -32,-0.0 2,-0.0 0, 0.0 -0.717 46.0 166.8 -96.2 130.3 13.6 -54.9 16.1 47 54 A K - 0 0 78 -2,-0.4 3,-0.1 1,-0.1 -3,-0.0 -0.991 28.1-154.4-139.1 138.2 16.9 -56.6 15.3 48 55 A P S S+ 0 0 2 0, 0.0 87,-2.2 0, 0.0 2,-0.3 0.691 84.4 16.2 -74.9 -25.1 17.7 -59.4 12.8 49 56 A R - 0 0 49 85,-0.2 3,-0.1 1,-0.2 85,-0.1 -0.990 63.5-136.4-153.3 153.0 20.7 -60.6 14.8 50 57 A A S S- 0 0 84 -2,-0.3 2,-0.4 1,-0.3 -1,-0.2 0.985 82.9 -1.7 -78.3 -64.1 22.3 -60.3 18.2 51 58 A S - 0 0 49 1,-0.1 3,-0.3 0, 0.0 -1,-0.3 -0.989 44.4-159.1-135.7 142.8 26.0 -59.7 17.7 52 59 A Y S > S+ 0 0 44 -2,-0.4 3,-1.2 1,-0.2 4,-0.1 0.327 71.2 97.9 -97.5 5.4 28.2 -59.6 14.6 53 60 A D T 3 S+ 0 0 125 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.633 74.7 62.9 -69.6 -13.5 31.5 -60.3 16.4 54 61 A D T 3 S+ 0 0 108 -3,-0.3 3,-0.4 1,-0.2 -1,-0.2 0.378 84.4 75.2 -94.0 3.3 31.4 -64.0 15.4 55 62 A I X + 0 0 8 -3,-1.2 3,-2.3 1,-0.2 32,-0.4 0.385 57.1 108.2 -96.9 3.2 31.6 -63.6 11.7 56 63 A D T 3 S+ 0 0 51 -3,-0.5 32,-2.5 1,-0.3 33,-0.3 0.723 82.0 47.6 -57.5 -24.7 35.3 -62.8 11.4 57 64 A D T 3 S+ 0 0 130 -3,-0.4 -1,-0.3 30,-0.2 -2,-0.1 0.453 79.9 128.9 -96.5 -2.0 36.1 -66.1 9.9 58 65 A L < - 0 0 46 -3,-2.3 29,-2.2 1,-0.1 2,-0.4 -0.309 59.5-125.2 -55.4 131.3 33.2 -66.0 7.3 59 66 A V E -G 86 0B 81 27,-0.2 27,-0.2 28,-0.1 -1,-0.1 -0.686 16.2-160.0 -90.3 129.3 34.7 -66.7 3.8 60 67 A I E -G 85 0B 0 25,-3.7 25,-2.0 -2,-0.4 67,-0.1 -0.909 14.4-167.6-101.7 103.5 34.2 -64.4 0.9 61 68 A P S S+ 0 0 82 0, 0.0 23,-0.2 0, 0.0 -1,-0.1 0.751 72.1 22.1 -71.4 -27.2 34.9 -66.9 -1.9 62 69 A A - 0 0 35 65,-0.3 65,-0.2 21,-0.1 21,-0.1 -0.439 68.5-177.8-144.4 65.9 35.3 -64.4 -4.8 63 70 A P - 0 0 0 0, 0.0 19,-2.8 0, 0.0 2,-0.4 -0.253 18.2-146.1 -58.4 152.8 36.1 -60.8 -4.0 64 71 A I E -HI 81 125C 18 61,-2.1 61,-3.3 17,-0.2 2,-0.5 -0.983 5.5-141.4-126.9 139.0 36.3 -58.5 -7.1 65 72 A Q E -HI 80 124C 39 15,-3.1 15,-2.2 -2,-0.4 2,-0.8 -0.869 22.7-138.6 -98.9 125.2 38.6 -55.6 -7.6 66 73 A Q E -H 79 0C 2 57,-2.6 2,-0.8 -2,-0.5 13,-0.2 -0.750 18.7-173.6 -96.5 109.0 36.7 -52.8 -9.4 67 74 A L E -H 78 0C 64 11,-3.0 11,-3.3 -2,-0.8 2,-0.4 -0.870 10.2-162.8-102.5 109.3 38.7 -51.0 -12.1 68 75 A V E -H 77 0C 5 -2,-0.8 2,-0.4 50,-0.5 9,-0.2 -0.763 6.5-172.1 -97.3 134.4 36.7 -48.1 -13.3 69 76 A T E +H 76 0C 53 7,-2.3 7,-2.9 -2,-0.4 2,-0.3 -0.983 35.6 56.5-129.7 132.7 37.6 -46.5 -16.7 70 77 A G E -H 75 0C 44 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.901 54.4-116.6 146.6-170.8 36.3 -43.3 -18.2 71 78 A Q E > S+H 74 0C 148 3,-1.4 3,-1.2 -2,-0.3 -2,-0.0 -0.992 70.7 33.9-159.0 160.2 35.8 -39.6 -17.8 72 79 A S T 3 S- 0 0 94 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.904 128.2 -47.2 60.8 47.5 33.3 -36.7 -17.5 73 80 A G T 3 S+ 0 0 9 42,-0.2 166,-1.8 1,-0.1 2,-0.5 0.467 119.2 102.5 76.9 4.1 30.6 -38.7 -15.7 74 81 A L E < +HJ 71 238C 39 -3,-1.2 -3,-1.4 164,-0.2 2,-0.3 -0.954 45.1 160.7-125.3 114.9 30.7 -41.7 -18.0 75 82 A F E -HJ 70 237C 11 162,-2.6 162,-2.7 -2,-0.5 2,-0.4 -0.934 32.2-150.6-136.1 152.7 32.5 -44.8 -16.9 76 83 A T E -HJ 69 236C 28 -7,-2.9 -7,-2.3 -2,-0.3 2,-0.5 -0.994 23.3-146.9-120.3 125.2 32.7 -48.5 -17.6 77 84 A Q E -H 68 0C 1 158,-2.9 2,-0.4 -2,-0.4 -9,-0.2 -0.818 9.8-162.8-102.0 128.9 33.7 -50.7 -14.7 78 85 A Y E -H 67 0C 90 -11,-3.3 -11,-3.0 -2,-0.5 2,-0.5 -0.841 10.6-139.8-109.7 144.4 35.8 -53.8 -15.1 79 86 A N E -H 66 0C 24 -2,-0.4 2,-0.6 -13,-0.2 -13,-0.2 -0.877 8.5-162.8-111.4 133.2 36.0 -56.6 -12.5 80 87 A I E -H 65 0C 71 -15,-2.2 -15,-3.1 -2,-0.5 2,-0.2 -0.962 22.9-129.4-113.5 116.9 39.1 -58.4 -11.5 81 88 A Q E -H 64 0C 129 -2,-0.6 2,-0.3 -17,-0.2 -17,-0.2 -0.461 26.8-164.3 -60.9 130.4 38.6 -61.7 -9.6 82 89 A K - 0 0 81 -19,-2.8 3,-0.1 -2,-0.2 -1,-0.0 -0.831 27.9 -91.1-117.6 157.9 40.6 -62.0 -6.4 83 90 A K - 0 0 158 -2,-0.3 -21,-0.1 -21,-0.1 -1,-0.1 -0.226 58.4 -83.1 -64.7 158.5 41.5 -65.0 -4.3 84 91 A A - 0 0 47 -23,-0.2 2,-0.3 -22,-0.1 -1,-0.1 -0.090 52.0-179.6 -62.0 158.4 39.1 -65.8 -1.4 85 92 A M E -G 60 0B 14 -25,-2.0 -25,-3.7 -3,-0.1 2,-0.2 -0.989 26.0-109.0-155.7 158.1 39.4 -64.0 1.9 86 93 A T E > -G 59 0B 33 -2,-0.3 4,-2.9 -27,-0.2 -27,-0.2 -0.540 32.8-113.2 -83.5 155.2 37.8 -63.9 5.3 87 94 A V H > S+ 0 0 1 -29,-2.2 4,-3.1 -32,-0.4 5,-0.2 0.899 119.3 58.4 -49.2 -44.5 35.7 -61.0 6.6 88 95 A R H > S+ 0 0 33 -32,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.949 109.3 41.8 -52.0 -54.4 38.5 -60.5 9.1 89 96 A E H > S+ 0 0 89 -33,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.927 113.4 53.7 -61.0 -46.1 41.1 -60.0 6.3 90 97 A F H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.932 106.5 51.5 -55.8 -48.3 38.7 -57.9 4.2 91 98 A R H X S+ 0 0 81 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.871 105.2 57.3 -57.0 -37.0 38.0 -55.5 7.1 92 99 A K H X S+ 0 0 114 -4,-1.6 4,-1.2 -5,-0.2 -1,-0.2 0.947 111.5 41.9 -60.3 -47.0 41.8 -55.0 7.5 93 100 A I H >< S+ 0 0 45 -4,-2.0 3,-0.7 2,-0.2 6,-0.5 0.950 111.6 54.1 -64.6 -49.3 42.1 -53.9 4.0 94 101 A A H 3< S+ 0 0 2 -4,-2.9 80,-0.3 1,-0.3 -1,-0.2 0.866 116.3 39.3 -53.5 -40.6 38.9 -51.7 4.0 95 102 A N H 3< S+ 0 0 89 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.600 89.8 114.6 -88.1 -12.8 40.2 -49.9 7.0 96 103 A S S XX S- 0 0 40 -4,-1.2 4,-2.1 -3,-0.7 3,-0.6 -0.195 82.1-112.4 -55.3 148.6 43.9 -49.8 5.9 97 104 A D T 34 S+ 0 0 152 1,-0.2 -1,-0.1 2,-0.2 -4,-0.1 0.791 116.5 59.5 -56.7 -28.5 45.1 -46.2 5.2 98 105 A K T 34 S+ 0 0 134 1,-0.2 -1,-0.2 -5,-0.1 -4,-0.1 0.909 121.3 21.1 -66.9 -44.9 45.3 -47.1 1.5 99 106 A Y T <4 S+ 0 0 25 -3,-0.6 75,-0.3 -6,-0.5 -2,-0.2 0.475 93.2 120.8-102.2 -4.0 41.6 -48.0 1.2 100 107 A C S < S- 0 0 49 -4,-2.1 -5,-0.1 -5,-0.1 175,-0.1 -0.188 74.3 -87.9 -68.9 155.2 39.9 -46.2 4.1 101 108 A T - 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