==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 19-SEP-06 2DYY . COMPND 2 MOLECULE: UPF0076 PROTEIN PH0854; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR IHSANAWATI,S.KISHISHITA,K.MURAYAMA,L.CHEN,Z.J.LIU,B.C.WANG, . 1456 24 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54621.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1037 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 107 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 357 24.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 0.8 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 . 124 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 19.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 1 3 1 1 0 2 3 0 1 0 0 0 0 2 6 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 11 0 0 0 0 11 1 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 . 19 4 5 19 12 0 12 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 . 4 0 0 0 0 3 9 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 1 A M 0 0 142 0, 0.0 23,-1.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 171.8 6.5 -9.4 66.5 2 2 A K E +A 23 0A 52 21,-0.2 2,-0.3 364,-0.1 21,-0.2 -0.679 360.0 173.9 -89.0 140.5 4.7 -6.2 67.7 3 3 A E E -A 22 0A 102 19,-1.5 19,-2.7 -2,-0.3 2,-0.4 -0.968 26.9-134.5-153.0 133.0 4.5 -5.4 71.4 4 4 A V E -A 21 0A 78 -2,-0.3 2,-0.5 17,-0.2 17,-0.2 -0.702 20.6-148.3 -87.0 131.3 3.3 -2.5 73.6 5 5 A I E +A 20 0A 9 15,-2.8 15,-0.9 -2,-0.4 14,-0.6 -0.869 20.4 175.0-102.1 128.6 5.6 -1.5 76.5 6 6 A F + 0 0 112 -2,-0.5 2,-0.3 58,-0.1 6,-0.1 -0.998 3.5 172.3-135.9 138.6 4.1 -0.1 79.6 7 7 A T > - 0 0 14 -2,-0.4 3,-0.7 4,-0.1 54,-0.1 -0.989 35.3-139.7-143.3 151.7 5.6 0.8 83.0 8 8 A E T 3 S+ 0 0 154 -2,-0.3 4,-0.1 1,-0.2 -1,-0.1 0.695 100.5 67.4 -80.1 -20.4 4.4 2.5 86.2 9 9 A N T 3 S+ 0 0 97 51,-0.1 -1,-0.2 2,-0.1 51,-0.2 0.338 95.6 62.5 -83.7 7.0 7.7 4.4 86.4 10 10 A A S < S- 0 0 4 -3,-0.7 -3,-0.1 27,-0.1 26,-0.1 -0.927 101.5 -83.2-128.7 154.3 7.0 6.5 83.3 11 11 A P - 0 0 22 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 -0.288 52.1-108.5 -57.1 139.6 4.2 9.1 82.7 12 12 A K - 0 0 136 25,-0.1 2,-0.2 -4,-0.1 6,-0.1 -0.540 34.5-114.6 -72.1 131.2 1.0 7.4 81.6 13 13 A P - 0 0 32 0, 0.0 2,-0.6 0, 0.0 6,-0.1 -0.465 24.3-138.0 -69.8 134.3 0.2 8.0 77.9 14 14 A I - 0 0 125 -2,-0.2 4,-0.1 4,-0.1 -2,-0.0 -0.843 62.7 -7.1 -98.2 114.3 -3.0 10.0 77.3 15 15 A G S S- 0 0 44 -2,-0.6 2,-2.2 1,-0.1 320,-0.0 -0.616 118.5 -17.5 105.4-166.5 -5.2 8.8 74.4 16 16 A P S S+ 0 0 24 0, 0.0 2,-0.3 0, 0.0 326,-0.2 -0.191 109.2 94.7 -73.9 48.7 -4.9 6.1 71.7 17 17 A Y - 0 0 14 -2,-2.2 2,-0.3 325,-0.2 327,-0.2 -0.831 59.8-137.6-134.7 173.9 -1.1 5.9 72.2 18 18 A S B -h 344 0B 10 325,-1.7 327,-0.7 -2,-0.3 3,-0.1 -0.892 24.3-121.4-131.6 162.0 1.7 4.0 74.1 19 19 A Q S S- 0 0 4 -14,-0.6 11,-3.1 -2,-0.3 2,-0.3 0.910 92.5 -21.6 -65.3 -44.5 4.9 4.7 75.9 20 20 A A E -AB 5 29A 0 -15,-0.9 -15,-2.8 9,-0.3 2,-0.4 -0.986 55.9-142.9-162.5 161.8 6.8 2.5 73.6 21 21 A I E -AB 4 28A 0 7,-2.2 7,-3.3 -2,-0.3 2,-0.6 -0.998 9.0-147.0-137.3 132.4 6.6 -0.3 71.1 22 22 A K E +AB 3 27A 35 -19,-2.7 -19,-1.5 -2,-0.4 2,-0.5 -0.879 21.0 175.8 -98.4 117.9 8.9 -3.1 70.4 23 23 A A E > -AB 2 26A 0 3,-2.7 3,-1.9 -2,-0.6 -21,-0.2 -0.965 65.0 -44.9-123.3 109.0 8.8 -4.1 66.7 24 24 A G T 3 S- 0 0 25 -23,-1.3 344,-0.0 -2,-0.5 342,-0.0 -0.459 121.7 -26.3 66.2-137.4 11.4 -6.7 65.9 25 25 A N T 3 S+ 0 0 81 -2,-0.1 100,-1.9 -3,-0.1 2,-0.4 0.381 121.7 96.1 -89.9 4.2 14.7 -5.9 67.5 26 26 A F E < -BC 23 124A 14 -3,-1.9 -3,-2.7 98,-0.2 2,-0.5 -0.779 59.1-156.5-100.6 141.5 13.8 -2.2 67.5 27 27 A L E -BC 22 123A 0 96,-2.4 96,-2.4 -2,-0.4 2,-0.7 -0.964 5.7-160.4-116.3 114.1 12.2 -0.3 70.4 28 28 A F E -BC 21 122A 7 -7,-3.3 -7,-2.2 -2,-0.5 2,-0.4 -0.853 8.6-162.4-100.4 110.9 10.3 2.9 69.4 29 29 A I E -BC 20 121A 0 92,-2.5 92,-0.7 -2,-0.7 -9,-0.3 -0.777 16.5-127.2 -94.7 131.3 9.9 5.2 72.4 30 30 A A E - 0 0 7 -11,-3.1 316,-0.2 -2,-0.4 91,-0.1 -0.332 45.1 -79.0 -70.4 158.6 7.3 7.9 72.3 31 31 A G E - 0 0 13 314,-1.3 2,-0.4 89,-0.1 89,-0.3 -0.317 50.2-147.9 -59.8 138.9 8.4 11.5 73.0 32 32 A Q E - C 0 119A 14 87,-2.6 87,-1.8 -3,-0.1 22,-0.1 -0.881 10.7-164.5-114.5 144.4 8.9 12.2 76.7 33 33 A I - 0 0 22 -2,-0.4 2,-3.0 85,-0.2 85,-0.2 -0.824 43.9 -87.2-119.7 161.0 8.3 15.4 78.6 34 34 A P S S+ 0 0 0 0, 0.0 9,-1.3 0, 0.0 2,-0.6 -0.221 72.2 142.7 -67.9 55.9 9.5 16.3 82.1 35 35 A I B -N 42 0C 36 -2,-3.0 7,-0.2 7,-0.2 -2,-0.1 -0.878 50.0-134.4 -99.7 124.4 6.6 14.9 84.0 36 36 A D > - 0 0 39 5,-2.4 4,-3.5 -2,-0.6 5,-0.5 -0.678 10.5-146.6 -77.6 111.1 7.4 13.2 87.3 37 37 A P T 4 S+ 0 0 32 0, 0.0 -1,-0.2 0, 0.0 -27,-0.1 0.720 95.3 48.7 -51.8 -24.0 5.5 9.9 87.2 38 38 A K T 4 S+ 0 0 171 -29,-0.1 -28,-0.0 3,-0.1 -2,-0.0 0.924 120.5 31.6 -83.7 -47.8 5.0 10.1 91.0 39 39 A T T 4 S- 0 0 60 2,-0.2 3,-0.1 -3,-0.1 -1,-0.1 0.811 95.9-137.5 -78.8 -32.6 3.8 13.6 91.4 40 40 A G < + 0 0 55 -4,-3.5 2,-0.3 1,-0.3 -5,-0.0 0.566 69.9 87.4 85.1 9.2 2.0 13.7 88.0 41 41 A E S S- 0 0 116 -5,-0.5 -5,-2.4 1,-0.1 -1,-0.3 -0.838 86.7 -76.5-134.7 171.7 3.3 17.2 87.2 42 42 A I B -N 35 0C 83 -2,-0.3 -7,-0.2 -7,-0.2 -1,-0.1 -0.310 53.0-114.0 -66.9 153.3 6.2 19.0 85.6 43 43 A V - 0 0 25 -9,-1.3 -1,-0.1 3,-0.1 7,-0.1 -0.183 56.9 -47.8 -81.8 176.8 9.4 19.3 87.8 44 44 A K S S- 0 0 175 1,-0.2 3,-0.1 5,-0.1 -2,-0.1 0.553 74.5-110.8 -5.3 -69.4 11.1 22.4 89.2 45 45 A G S S+ 0 0 43 1,-0.4 2,-0.3 0, 0.0 -1,-0.2 0.389 77.9 115.9 134.2 7.1 11.1 24.5 86.1 46 46 A D S > S- 0 0 56 1,-0.1 4,-2.5 70,-0.0 -1,-0.4 -0.815 70.1-123.5-105.9 145.3 14.8 24.6 85.2 47 47 A I H > S+ 0 0 22 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.864 109.6 52.8 -52.8 -43.8 16.3 23.0 82.1 48 48 A K H > S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.948 113.6 41.3 -58.5 -53.2 18.7 20.8 84.0 49 49 A D H > S+ 0 0 54 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.856 116.3 50.6 -66.1 -35.0 16.0 19.3 86.2 50 50 A Q H X S+ 0 0 6 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.888 109.4 49.4 -70.4 -40.2 13.7 19.0 83.3 51 51 A T H X S+ 0 0 0 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.856 111.1 52.3 -67.1 -33.0 16.3 17.2 81.1 52 52 A R H X S+ 0 0 71 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.953 107.9 48.6 -68.2 -49.5 17.0 14.9 83.9 53 53 A Q H X S+ 0 0 19 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.906 111.4 50.8 -57.2 -45.5 13.3 13.8 84.4 54 54 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.942 112.4 45.7 -58.3 -49.8 12.9 13.2 80.7 55 55 A L H X S+ 0 0 2 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.897 111.9 52.2 -62.4 -37.1 16.0 11.0 80.6 56 56 A E H X S+ 0 0 81 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.910 109.9 49.5 -64.9 -38.4 14.8 9.2 83.7 57 57 A N H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.949 111.0 48.7 -63.8 -48.5 11.5 8.6 82.1 58 58 A I H X S+ 0 0 3 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.917 108.7 54.5 -57.3 -43.8 13.2 7.3 79.0 59 59 A K H X S+ 0 0 68 -4,-2.8 4,-3.2 1,-0.2 -1,-0.2 0.902 105.7 52.6 -57.4 -43.6 15.4 5.0 81.1 60 60 A A H X S+ 0 0 10 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.941 109.6 47.1 -59.2 -49.9 12.3 3.5 82.8 61 61 A I H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 6,-0.2 0.955 112.9 49.4 -58.7 -48.8 10.6 2.6 79.5 62 62 A L H ><>S+ 0 0 0 -4,-2.5 5,-2.8 1,-0.2 3,-0.5 0.951 113.4 47.6 -52.1 -52.4 13.9 1.1 78.2 63 63 A E H ><5S+ 0 0 122 -4,-3.2 3,-1.2 1,-0.2 -1,-0.2 0.861 108.1 54.9 -56.5 -39.8 14.2 -0.9 81.5 64 64 A A H 3<5S+ 0 0 49 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.842 109.6 47.6 -65.7 -31.2 10.6 -2.0 81.2 65 65 A A T <<5S- 0 0 8 -4,-2.0 -1,-0.3 -3,-0.5 -2,-0.2 0.356 121.3-105.1 -90.8 5.3 11.3 -3.4 77.7 66 66 A G T < 5S+ 0 0 51 -3,-1.2 2,-0.2 1,-0.3 -3,-0.2 0.751 82.1 122.5 78.4 24.0 14.4 -5.2 78.8 67 67 A Y < - 0 0 12 -5,-2.8 -1,-0.3 -6,-0.2 2,-0.2 -0.664 47.4-146.1-111.9 168.4 16.8 -2.7 77.1 68 68 A S > - 0 0 41 -2,-0.2 3,-1.5 -3,-0.1 4,-0.4 -0.770 33.3 -96.9-127.3 174.1 19.6 -0.5 78.5 69 69 A L G > S+ 0 0 34 1,-0.3 3,-1.6 -2,-0.2 -1,-0.0 0.874 119.5 60.2 -62.2 -36.3 20.9 2.9 77.8 70 70 A N G 3 S+ 0 0 82 1,-0.3 -1,-0.3 53,-0.0 26,-0.0 0.534 94.9 65.6 -72.5 0.8 23.7 1.6 75.5 71 71 A D G < S+ 0 0 23 -3,-1.5 53,-2.9 52,-0.0 -1,-0.3 0.617 75.0 106.1 -92.7 -14.3 21.0 0.1 73.3 72 72 A V E < +D 123 0A 0 -3,-1.6 51,-0.3 -4,-0.4 3,-0.1 -0.492 39.5 170.8 -66.9 127.2 19.7 3.5 72.3 73 73 A I E + 0 0 0 49,-3.0 29,-2.7 1,-0.3 2,-0.4 0.671 61.5 30.0-110.8 -27.8 20.8 4.3 68.7 74 74 A K E +De 122 102A 15 48,-1.6 48,-2.4 27,-0.2 2,-0.4 -0.994 57.9 179.4-140.4 134.8 18.9 7.5 67.8 75 75 A V E -De 121 103A 0 27,-2.4 29,-1.2 -2,-0.4 2,-0.4 -0.994 9.3-162.2-133.4 136.3 17.7 10.4 69.9 76 76 A T E -De 120 104A 1 44,-2.4 44,-2.3 -2,-0.4 2,-0.5 -0.989 10.1-160.5-121.3 130.2 15.8 13.5 68.8 77 77 A V E -De 119 105A 0 27,-3.2 29,-2.2 -2,-0.4 2,-0.5 -0.953 5.6-166.3-118.3 125.3 15.6 16.5 71.1 78 78 A Y E -De 118 106A 2 40,-2.6 40,-1.7 -2,-0.5 2,-0.3 -0.946 13.4-179.3-111.3 121.7 13.1 19.3 70.8 79 79 A L E -De 117 107A 6 27,-1.9 29,-3.7 -2,-0.5 2,-0.9 -0.799 34.1-123.6-117.0 161.3 13.8 22.5 72.8 80 80 A K 0 0 78 36,-1.3 29,-0.1 -2,-0.3 27,-0.1 -0.625 360.0 360.0-103.1 71.4 11.9 25.7 73.2 81 81 A D 0 0 88 -2,-0.9 -1,-0.2 150,-0.1 26,-0.1 0.998 360.0 360.0 70.8 360.0 14.6 28.1 72.0 82 ! 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 83 83 A N 0 0 102 0, 0.0 -2,-0.1 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 101.1 19.2 29.1 74.0 84 84 A D >> + 0 0 39 1,-0.1 2,-2.0 32,-0.1 4,-1.2 0.129 360.0 121.0-110.0 15.3 19.5 26.5 76.8 85 85 A F T 34 + 0 0 41 1,-0.2 -1,-0.1 2,-0.1 -6,-0.0 -0.194 67.7 58.8 -75.4 46.8 20.9 23.9 74.3 86 86 A A T 3> S+ 0 0 75 -2,-2.0 4,-0.6 3,-0.0 -1,-0.2 0.490 99.8 46.0-139.4 -43.3 24.1 23.7 76.4 87 87 A K H X> S+ 0 0 37 -3,-0.7 4,-1.3 1,-0.2 3,-1.0 0.865 103.5 67.8 -73.2 -36.2 23.1 22.6 80.0 88 88 A M H 3X S+ 0 0 2 -4,-1.2 4,-2.1 1,-0.3 -1,-0.2 0.859 97.5 54.1 -48.9 -41.0 20.9 19.9 78.4 89 89 A N H 3> S+ 0 0 38 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.800 98.5 60.9 -66.8 -33.0 24.1 18.2 77.2 90 90 A E H X S+ 0 0 1 -4,-1.3 4,-1.0 1,-0.2 3,-0.7 0.887 115.6 57.2 -73.4 -40.1 22.8 15.9 81.9 92 92 A Y H 3X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 3,-0.3 0.835 99.9 58.8 -59.4 -36.2 22.5 14.1 78.6 93 93 A A H 3X S+ 0 0 40 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.822 96.0 62.4 -65.9 -31.8 26.1 13.0 78.7 94 94 A E H << S+ 0 0 115 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.908 115.7 32.0 -58.7 -41.3 25.5 11.1 82.0 95 95 A Y H < S+ 0 0 26 -4,-1.0 -2,-0.2 -3,-0.3 4,-0.2 0.766 139.7 16.2 -88.3 -30.4 23.1 8.9 80.2 96 96 A F H X S+ 0 0 3 -4,-2.4 4,-1.9 2,-0.1 -3,-0.2 0.325 86.1 111.0-128.6 8.8 24.6 8.7 76.7 97 97 A G T < S+ 0 0 27 -4,-2.5 -3,-0.1 -5,-0.3 -4,-0.1 0.816 89.1 35.4 -54.2 -33.3 28.1 10.0 77.0 98 98 A E T 4 S+ 0 0 153 -5,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 0.943 121.2 38.7 -89.1 -54.6 29.6 6.5 76.3 99 99 A S T 4 S- 0 0 22 -4,-0.2 -2,-0.2 44,-0.0 -1,-0.1 0.722 88.7-157.3 -70.0 -19.4 27.3 4.8 73.7 100 100 A K < - 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