==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 15-MAR-07 2P5D . COMPND 2 MOLECULE: UPF0310 PROTEIN MJECL36; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR M.SUGAHARA,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 145 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 24.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 17 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 2 0 1 1 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 . 0 1 0 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 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 0 201 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 167.1 9.0 19.3 -12.1 2 2 A D - 0 0 130 1,-0.1 3,-0.1 3,-0.0 2,-0.1 -0.175 360.0 -91.3 -66.0 162.1 10.5 19.6 -8.6 3 3 A L - 0 0 156 1,-0.1 -1,-0.1 39,-0.0 39,-0.0 -0.363 51.8 -87.2 -73.6 154.9 8.9 17.9 -5.6 4 4 A M - 0 0 86 37,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.310 44.7-149.0 -61.2 144.4 6.4 19.8 -3.4 5 5 A A - 0 0 11 34,-0.2 38,-2.2 -3,-0.1 2,-0.5 -0.777 3.2-138.6-113.9 160.6 7.9 21.9 -0.6 6 6 A Y E -aB 43 135A 14 129,-0.6 129,-2.6 -2,-0.3 2,-0.5 -0.986 18.4-164.2-123.6 126.4 6.5 22.8 2.8 7 7 A W E -aB 44 134A 14 36,-2.9 38,-3.3 -2,-0.5 2,-0.5 -0.944 15.9-147.6-121.4 124.8 6.9 26.3 4.2 8 8 A L E -aB 45 133A 8 125,-3.6 125,-2.2 -2,-0.5 2,-0.6 -0.743 22.8-157.8 -83.1 125.2 6.4 27.5 7.7 9 9 A C E -aB 46 132A 0 36,-3.1 38,-3.2 -2,-0.5 2,-0.5 -0.938 5.1-143.7-112.3 119.1 5.2 31.1 7.4 10 10 A I E +a 47 0A 32 121,-2.3 2,-0.2 -2,-0.6 38,-0.2 -0.695 34.8 147.3 -87.2 122.1 5.7 33.4 10.4 11 11 A T E -a 48 0A 15 36,-3.1 38,-2.7 -2,-0.5 2,-0.2 -0.819 37.3-114.8-141.3 178.7 3.0 36.0 11.1 12 12 A N > - 0 0 54 -2,-0.2 4,-1.7 36,-0.2 5,-0.2 -0.570 40.0 -91.3-111.8 179.5 1.3 37.8 13.9 13 13 A E H > S+ 0 0 58 1,-0.2 4,-1.2 2,-0.2 -1,-0.0 0.882 122.1 48.2 -58.5 -43.4 -2.3 37.8 15.4 14 14 A D H > S+ 0 0 76 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.926 114.3 44.2 -66.4 -45.2 -3.6 40.6 13.2 15 15 A N H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.727 103.1 64.4 -75.3 -20.5 -2.2 39.2 9.9 16 16 A W H X S+ 0 0 10 -4,-1.7 4,-2.9 1,-0.2 5,-0.2 0.936 101.6 52.8 -63.9 -43.0 -3.3 35.7 10.6 17 17 A K H X S+ 0 0 135 -4,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.860 110.3 47.5 -58.6 -36.2 -6.9 37.0 10.5 18 18 A V H X S+ 0 0 29 -4,-0.9 4,-3.3 2,-0.2 5,-0.4 0.920 112.1 48.2 -71.5 -45.0 -6.1 38.6 7.1 19 19 A I H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.906 111.8 51.2 -60.9 -42.2 -4.6 35.4 5.7 20 20 A K H < S+ 0 0 91 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.896 119.0 36.1 -63.1 -41.4 -7.5 33.4 7.0 21 21 A E H < S+ 0 0 142 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.905 127.6 31.8 -80.6 -44.9 -10.0 35.7 5.3 22 22 A K H < S- 0 0 112 -4,-3.3 74,-0.2 2,-0.2 -3,-0.2 0.623 90.7-138.0 -90.5 -16.3 -8.3 36.7 2.1 23 23 A K < + 0 0 87 -4,-1.9 73,-2.6 -5,-0.4 2,-0.3 0.942 60.7 122.7 54.8 52.7 -6.4 33.4 1.5 24 24 A I E -E 95 0B 18 71,-0.2 2,-0.4 -5,-0.2 -1,-0.2 -0.991 46.5-157.5-141.2 139.6 -3.2 35.3 0.4 25 25 A W E +E 94 0B 11 69,-2.0 69,-1.9 -2,-0.3 2,-0.3 -0.974 19.8 177.0-118.5 136.3 0.3 35.0 1.9 26 26 A G E -E 93 0B 6 -2,-0.4 2,-0.3 67,-0.2 67,-0.2 -0.978 13.5-165.7-142.0 154.8 2.8 37.9 1.4 27 27 A V E -E 92 0B 3 65,-2.3 65,-1.7 -2,-0.3 2,-0.1 -0.879 26.3-103.6-132.5 166.6 6.3 38.9 2.3 28 28 A A > - 0 0 12 -2,-0.3 3,-2.0 62,-0.2 4,-0.2 -0.393 41.7 -95.7 -86.7 166.2 8.4 42.1 2.2 29 29 A E G > S+ 0 0 95 1,-0.3 3,-1.9 2,-0.2 4,-0.4 0.861 121.2 63.8 -45.0 -47.1 11.2 43.0 -0.2 30 30 A R G 3 S+ 0 0 200 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.763 111.6 35.9 -53.0 -29.3 13.8 41.7 2.2 31 31 A Y G X> S+ 0 0 52 -3,-2.0 4,-1.8 1,-0.1 3,-1.0 0.187 79.5 107.2-113.8 17.6 12.4 38.2 1.9 32 32 A K H <> S+ 0 0 64 -3,-1.9 4,-2.3 1,-0.3 -1,-0.1 0.836 74.4 66.9 -64.0 -28.3 11.3 38.1 -1.7 33 33 A N H 34 S+ 0 0 121 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.823 105.6 41.1 -59.5 -33.5 14.3 35.7 -2.3 34 34 A T H X4 S+ 0 0 38 -3,-1.0 3,-1.8 2,-0.2 -2,-0.2 0.921 114.0 48.3 -83.1 -47.0 12.6 33.1 -0.1 35 35 A I H >< S+ 0 0 0 -4,-1.8 3,-2.1 1,-0.3 -2,-0.2 0.824 100.1 68.7 -64.8 -27.6 9.1 33.4 -1.3 36 36 A N T 3< S+ 0 0 95 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.654 90.1 64.1 -65.4 -11.8 10.3 33.3 -4.9 37 37 A K T < S+ 0 0 137 -3,-1.8 -1,-0.3 -5,-0.1 2,-0.2 0.524 84.3 101.6 -85.7 -7.3 11.3 29.6 -4.2 38 38 A V < - 0 0 11 -3,-2.1 33,-0.4 -4,-0.2 2,-0.3 -0.505 50.8-178.3 -80.1 145.6 7.6 28.8 -3.7 39 39 A K > - 0 0 57 -2,-0.2 3,-2.2 31,-0.1 28,-0.2 -0.943 38.3 -74.9-141.0 162.0 5.6 27.1 -6.5 40 40 A V T 3 S+ 0 0 73 -2,-0.3 28,-0.2 1,-0.3 3,-0.1 -0.297 117.5 33.3 -56.0 135.4 2.0 25.9 -7.1 41 41 A G T 3 S+ 0 0 11 26,-2.4 -1,-0.3 1,-0.4 27,-0.1 0.157 88.9 123.0 102.7 -19.0 1.3 22.8 -5.2 42 42 A D < - 0 0 0 -3,-2.2 25,-2.7 -38,-0.1 -1,-0.4 -0.265 58.2-126.3 -69.8 164.4 3.5 23.7 -2.2 43 43 A K E -aC 6 66A 23 -38,-2.2 -36,-2.9 23,-0.2 2,-0.4 -0.930 13.2-153.1-117.6 140.1 2.0 23.9 1.3 44 44 A L E -aC 7 65A 0 21,-2.6 21,-2.5 -2,-0.4 2,-0.6 -0.937 2.2-158.7-112.4 133.0 2.1 26.8 3.7 45 45 A I E -aC 8 64A 0 -38,-3.3 -36,-3.1 -2,-0.4 2,-0.6 -0.955 18.5-138.5-112.4 112.8 1.9 26.2 7.4 46 46 A I E -aC 9 63A 0 17,-2.4 16,-2.2 -2,-0.6 17,-0.8 -0.624 17.7-168.0 -80.9 118.9 0.9 29.4 9.2 47 47 A Y E -aC 10 61A 11 -38,-3.2 -36,-3.1 -2,-0.6 2,-0.6 -0.921 5.9-157.8-108.5 121.8 2.7 30.1 12.4 48 48 A E E -aC 11 60A 2 12,-3.0 12,-2.6 -2,-0.5 -36,-0.2 -0.895 26.7-117.6-103.5 115.2 1.4 32.8 14.7 49 49 A I - 0 0 59 -38,-2.7 -36,-0.1 -2,-0.6 -1,-0.0 -0.018 30.6 -97.4 -53.5 150.3 4.0 34.2 17.0 50 50 A Q - 0 0 50 9,-0.1 2,-0.7 1,-0.1 -1,-0.1 -0.286 26.1-133.7 -64.1 149.8 3.8 34.0 20.8 51 51 A R B -G 57 0C 96 6,-2.5 6,-2.0 2,-0.1 2,-0.1 -0.946 27.6-156.1-105.7 108.4 2.5 36.9 22.7 52 52 A S + 0 0 91 -2,-0.7 3,-0.3 4,-0.2 2,-0.2 -0.467 45.9 44.9 -85.1 162.9 4.9 37.4 25.6 53 53 A G S > S- 0 0 54 1,-0.2 3,-1.0 -2,-0.1 -2,-0.1 -0.564 108.4 -32.0 107.1-170.4 4.0 39.1 28.9 54 54 A K T 3 S+ 0 0 214 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.0 0.688 135.0 53.2 -62.5 -21.2 1.2 39.0 31.4 55 55 A D T 3 S- 0 0 127 -3,-0.3 -1,-0.3 2,-0.1 -4,-0.1 -0.323 90.2-174.9-108.5 47.5 -1.4 38.3 28.7 56 56 A Y < - 0 0 109 -3,-1.0 -4,-0.2 -6,-0.1 -2,-0.1 -0.099 13.8-177.8 -49.1 134.1 0.7 35.3 27.4 57 57 A K B -G 51 0C 9 -6,-2.0 -6,-2.5 3,-0.0 3,-0.1 -0.992 25.7-124.5-134.9 123.5 -0.4 33.5 24.3 58 58 A P - 0 0 17 0, 0.0 2,-0.2 0, 0.0 -10,-0.0 -0.189 37.4 -88.5 -65.4 160.1 1.5 30.4 23.1 59 59 A P - 0 0 0 0, 0.0 49,-2.5 0, 0.0 50,-0.5 -0.543 56.0-152.7 -68.3 133.5 3.0 30.3 19.6 60 60 A Y E -CD 48 107A 45 -12,-2.6 -12,-3.0 -2,-0.2 2,-0.7 -0.857 26.7-146.1-114.6 142.9 0.3 28.8 17.4 61 61 A I E -CD 47 106A 0 45,-2.4 45,-1.8 -2,-0.4 -14,-0.2 -0.924 26.9-179.4 -96.0 110.5 -0.0 26.8 14.2 62 62 A R E - 0 0 45 -16,-2.2 40,-1.6 -2,-0.7 2,-0.3 0.819 48.6 -43.5 -84.1 -32.5 -3.2 28.3 12.8 63 63 A G E -CD 46 101A 0 -17,-0.8 -17,-2.4 38,-0.2 2,-0.4 -0.995 45.8-105.8-179.7 176.6 -3.7 26.4 9.6 64 64 A V E -CD 45 100A 0 36,-2.7 35,-2.3 -2,-0.3 36,-1.9 -0.979 30.2-173.4-127.6 140.6 -2.4 24.9 6.4 65 65 A Y E -CD 44 98A 0 -21,-2.5 -21,-2.6 -2,-0.4 2,-0.4 -0.912 21.8-128.1-133.3 157.6 -2.8 26.1 2.9 66 66 A E E -CD 43 97A 45 31,-2.7 31,-1.9 -2,-0.3 2,-0.5 -0.891 27.6-124.8-105.0 133.1 -2.1 25.1 -0.7 67 67 A V E + D 0 96A 0 -25,-2.7 -26,-2.4 -2,-0.4 29,-0.2 -0.680 32.8 173.6 -78.1 125.1 -0.3 27.5 -2.9 68 68 A V + 0 0 66 27,-2.6 2,-0.3 -2,-0.5 28,-0.2 0.188 55.9 45.4-120.3 16.5 -2.4 28.0 -6.0 69 69 A S S S- 0 0 13 26,-0.6 3,-0.1 -30,-0.1 -28,-0.1 -0.986 81.2-106.2-152.4 157.6 -0.6 30.7 -7.9 70 70 A E - 0 0 131 -2,-0.3 25,-0.3 1,-0.1 2,-0.2 -0.323 61.5 -76.4 -74.0 167.6 2.9 31.7 -8.9 71 71 A V - 0 0 30 -33,-0.4 2,-0.3 -35,-0.1 23,-0.2 -0.500 60.6-178.8 -68.6 133.3 4.4 34.6 -6.9 72 72 A Y E -F 93 0B 45 21,-2.6 21,-2.8 -2,-0.2 2,-0.5 -0.871 25.6-119.6-130.4 163.8 3.0 37.9 -8.1 73 73 A K E +F 92 0B 132 -2,-0.3 2,-0.3 19,-0.2 19,-0.2 -0.930 39.1 153.8-111.1 126.4 3.6 41.5 -7.1 74 74 A D - 0 0 55 17,-2.3 -2,-0.1 -2,-0.5 0, 0.0 -0.926 24.0-170.9-152.5 120.8 0.7 43.6 -5.7 75 75 A S + 0 0 69 -2,-0.3 2,-0.1 2,-0.1 17,-0.1 0.361 43.9 129.1 -95.9 5.2 1.0 46.6 -3.4 76 76 A S - 0 0 58 1,-0.1 2,-0.2 15,-0.1 -2,-0.1 -0.408 69.6-106.5 -60.2 132.9 -2.7 46.9 -2.7 77 77 A K + 0 0 136 1,-0.2 -1,-0.1 -2,-0.1 12,-0.1 -0.451 66.7 131.1 -70.7 128.4 -3.0 47.1 1.1 78 78 A I + 0 0 43 11,-0.3 2,-0.2 -2,-0.2 -1,-0.2 0.426 56.6 69.0-143.2 -29.1 -4.4 44.0 2.9 79 79 A F S S- 0 0 14 10,-0.3 -1,-0.1 9,-0.1 -64,-0.1 -0.552 81.7-109.0 -98.7 163.7 -1.9 43.3 5.7 80 80 A K - 0 0 110 -2,-0.2 -65,-0.1 -3,-0.1 2,-0.1 -0.802 34.0-153.2 -93.2 121.0 -1.2 45.3 8.9 81 81 A P - 0 0 22 0, 0.0 8,-0.0 0, 0.0 6,-0.0 -0.347 18.0-108.1 -86.8 173.0 2.2 47.0 8.9 82 82 A T B > -H 85 0D 54 3,-0.6 3,-0.7 -2,-0.1 6,-0.3 -0.673 26.1-114.5 -98.4 157.8 4.4 47.8 11.9 83 83 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.725 116.3 50.3 -63.1 -22.5 4.9 51.4 13.2 84 84 A R T 3 S+ 0 0 222 1,-0.2 3,-0.1 2,-0.1 0, 0.0 0.678 123.4 29.7 -89.7 -19.7 8.6 51.4 12.4 85 85 A N B X S+H 82 0D 70 -3,-0.7 3,-1.6 1,-0.1 -3,-0.6 -0.471 77.7 155.4-134.3 58.1 8.0 50.1 8.8 86 86 A P T 3 + 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.651 67.3 58.8 -60.3 -23.6 4.6 51.7 8.3 87 87 A N T 3 S+ 0 0 137 -3,-0.1 2,-0.2 -4,-0.0 -3,-0.0 0.388 77.0 125.0 -91.6 5.0 4.8 51.8 4.5 88 88 A E < + 0 0 51 -3,-1.6 -3,-0.1 -6,-0.3 -60,-0.1 -0.446 28.4 170.4 -68.3 132.3 5.3 48.1 4.3 89 89 A K - 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