==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-MAR-05 1Z85 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TM1380; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 428 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21260.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 292 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 13.6 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 39 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 0 0 0 0 1 2 1 0 0 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 1 4 4 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 . 2 0 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 P 0 0 142 0, 0.0 2,-0.1 0, 0.0 33,-0.1 0.000 360.0 360.0 360.0 96.4 18.9 43.9 6.2 2 3 A H - 0 0 89 24,-0.1 33,-0.5 128,-0.0 2,-0.4 -0.394 360.0-145.7 -89.7 164.6 15.1 44.0 6.3 3 4 A L - 0 0 4 -2,-0.1 33,-0.2 124,-0.1 2,-0.2 -1.000 16.0-163.8-132.0 130.2 12.8 43.1 9.1 4 5 A F E -a 36 0A 3 31,-1.9 33,-1.9 -2,-0.4 2,-0.5 -0.641 15.1-128.5-114.3 163.8 9.4 41.5 8.4 5 6 A Y E +a 37 0A 66 31,-0.2 11,-0.4 -2,-0.2 2,-0.2 -0.970 40.5 145.3-120.0 126.5 6.4 41.2 10.6 6 7 A G - 0 0 4 31,-2.0 2,-0.5 -2,-0.5 9,-0.2 -0.803 46.9 -95.2-147.6-176.5 4.7 37.8 11.1 7 8 A T E -B 14 0A 76 7,-2.8 7,-2.8 -2,-0.2 2,-0.5 -0.952 33.3-143.3-113.9 122.6 2.8 35.4 13.5 8 9 A A E +B 13 0A 38 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.732 30.6 157.3 -91.0 126.6 4.8 32.8 15.4 9 10 A Q E > -B 12 0A 82 3,-2.8 3,-1.8 -2,-0.5 -2,-0.0 -0.939 62.6 -21.7-153.3 124.5 3.3 29.4 15.9 10 11 A N T 3 S- 0 0 176 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.800 127.6 -39.5 47.1 43.2 4.8 25.9 16.6 11 12 A G T 3 S+ 0 0 43 1,-0.3 49,-2.5 48,-0.1 2,-0.3 0.477 122.3 81.1 93.3 1.8 8.2 26.7 15.2 12 13 A E E < -BC 9 59A 75 -3,-1.8 -3,-2.8 47,-0.3 2,-0.5 -0.935 65.3-135.0-130.9 159.4 7.4 28.8 12.2 13 14 A V E -BC 8 58A 1 45,-2.4 45,-2.1 -2,-0.3 2,-0.4 -0.968 21.6-156.7-110.6 128.0 6.5 32.4 11.4 14 15 A I E -BC 7 57A 58 -7,-2.8 -7,-2.8 -2,-0.5 2,-0.3 -0.860 7.8-161.1-104.1 147.4 3.7 33.0 9.0 15 16 A F E - C 0 56A 9 41,-2.3 41,-1.6 -2,-0.4 -9,-0.1 -0.895 10.8-128.4-130.9 151.7 3.3 36.2 6.9 16 17 A D > - 0 0 73 -11,-0.4 4,-2.2 -2,-0.3 5,-0.1 -0.165 42.3 -87.1 -93.1-177.7 0.4 37.8 5.1 17 18 A E H > S+ 0 0 75 37,-0.3 4,-3.2 1,-0.2 5,-0.3 0.865 124.1 60.6 -64.5 -37.8 0.3 39.1 1.5 18 19 A R H > S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.949 111.5 39.7 -52.2 -48.0 1.7 42.6 2.5 19 20 A E H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.919 114.7 52.5 -72.3 -40.2 4.9 40.9 3.7 20 21 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.925 109.9 48.7 -58.4 -48.4 5.0 38.3 0.9 21 22 A H H X S+ 0 0 111 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.950 111.3 50.5 -56.8 -50.6 4.8 41.1 -1.7 22 23 A H H X S+ 0 0 47 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.917 106.5 55.0 -54.4 -44.8 7.5 43.0 0.2 23 24 A X H <>S+ 0 0 0 -4,-3.0 5,-2.7 1,-0.2 -1,-0.2 0.926 108.8 48.3 -55.9 -42.4 9.7 40.0 0.2 24 25 A R H ><5S+ 0 0 91 -4,-2.1 3,-1.2 3,-0.2 -2,-0.2 0.893 106.9 56.0 -65.6 -39.3 9.4 39.8 -3.6 25 26 A V H 3<5S+ 0 0 93 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.905 110.5 45.1 -58.9 -39.9 10.2 43.5 -4.0 26 27 A V T 3<5S- 0 0 43 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.389 117.8-115.3 -92.0 9.5 13.5 42.9 -2.1 27 28 A R T < 5 + 0 0 155 -3,-1.2 -3,-0.2 1,-0.2 2,-0.2 0.809 54.4 164.1 72.2 35.3 14.2 39.8 -4.2 28 29 A L < - 0 0 36 -5,-2.7 2,-0.3 -6,-0.2 -1,-0.2 -0.580 15.0-167.1 -80.7 150.2 14.0 37.2 -1.4 29 30 A K > - 0 0 95 -2,-0.2 3,-2.3 19,-0.0 19,-0.2 -0.924 35.1 -78.0-133.2 157.5 13.7 33.5 -2.3 30 31 A E T 3 S+ 0 0 116 -2,-0.3 19,-0.2 1,-0.3 3,-0.1 -0.314 118.4 37.2 -52.7 129.8 12.9 30.3 -0.5 31 32 A G T 3 S+ 0 0 48 17,-3.0 -1,-0.3 1,-0.4 18,-0.1 0.100 87.5 122.9 107.2 -21.3 16.0 29.2 1.4 32 33 A D < - 0 0 56 -3,-2.3 16,-3.4 15,-0.1 2,-0.5 -0.402 65.6-117.0 -69.8 148.4 17.1 32.7 2.4 33 34 A V E + D 0 47A 100 14,-0.2 2,-0.3 -3,-0.1 14,-0.2 -0.775 40.8 178.3 -81.9 126.5 17.7 33.7 6.1 34 35 A I E - D 0 46A 8 12,-2.3 12,-2.8 -2,-0.5 2,-0.4 -0.856 25.2-133.3-125.0 160.5 15.3 36.4 7.1 35 36 A E E + D 0 45A 45 -33,-0.5 -31,-1.9 -2,-0.3 2,-0.3 -0.989 27.8 175.8-112.3 129.2 14.6 38.3 10.4 36 37 A A E -aD 4 44A 0 8,-2.2 8,-2.8 -2,-0.4 2,-0.3 -0.841 16.4-151.6-121.7 160.0 11.0 38.8 11.6 37 38 A T E -aD 5 43A 0 -33,-1.9 -31,-2.0 -2,-0.3 6,-0.2 -0.959 13.7-146.3-124.0 152.5 9.4 40.3 14.7 38 39 A D - 0 0 20 4,-1.1 5,-0.1 -2,-0.3 -33,-0.1 0.562 45.0-116.1 -87.4 -11.5 6.0 39.3 16.2 39 40 A G S S+ 0 0 6 3,-0.5 95,-1.8 93,-0.4 4,-0.1 0.513 98.5 96.3 81.9 10.7 5.4 42.9 17.4 40 41 A N B S-F 133 0B 109 2,-0.2 93,-0.3 93,-0.2 29,-0.1 0.082 113.0 -79.8-117.8 16.0 5.6 41.7 20.9 41 42 A G S S+ 0 0 0 91,-2.6 25,-3.2 1,-0.3 26,-1.6 0.321 95.3 112.9 107.9 -4.5 9.3 42.4 21.7 42 43 A F E - E 0 65A 62 90,-0.5 -4,-1.1 23,-0.2 -3,-0.5 -0.799 50.0-152.3-112.9 147.7 10.9 39.4 20.0 43 44 A S E -DE 37 64A 2 21,-3.1 21,-2.7 -2,-0.3 2,-0.4 -0.893 12.7-161.7-108.4 138.9 13.2 38.9 17.0 44 45 A Y E -DE 36 63A 24 -8,-2.8 -8,-2.2 -2,-0.4 2,-0.6 -0.995 8.4-154.2-125.9 117.7 13.1 35.6 15.1 45 46 A T E +DE 35 62A 41 17,-2.5 16,-3.2 -2,-0.4 17,-1.9 -0.859 34.0 171.0 -88.4 121.3 15.9 34.5 12.8 46 47 A C E -DE 34 60A 0 -12,-2.8 -12,-2.3 -2,-0.6 2,-0.5 -0.883 38.9-123.2-128.0 163.3 14.2 32.2 10.3 47 48 A I E -DE 33 59A 49 12,-2.3 12,-2.5 -2,-0.3 2,-0.3 -0.951 37.2-120.4-105.3 124.4 14.9 30.3 7.1 48 49 A L E + E 0 58A 0 -16,-3.4 -17,-3.0 -2,-0.5 10,-0.3 -0.421 39.5 168.7 -66.8 120.6 12.3 31.2 4.5 49 50 A K E + 0 0 117 8,-2.5 2,-0.4 1,-0.4 9,-0.2 0.843 61.4 20.7-106.1 -41.4 10.5 28.0 3.5 50 51 A S E - E 0 57A 31 7,-2.7 7,-2.4 -21,-0.1 2,-0.4 -0.998 52.2-179.4-135.6 131.4 7.6 29.1 1.4 51 52 A L E + E 0 56A 30 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.887 22.9 162.8-132.0 97.7 7.0 32.3 -0.5 52 53 A K - 0 0 131 3,-2.6 -2,-0.0 -2,-0.4 0, 0.0 -0.541 50.8 -96.6-110.2 176.7 3.6 32.3 -2.2 53 54 A K S S+ 0 0 131 1,-0.2 -32,-0.1 -2,-0.2 -33,-0.1 0.942 119.2 20.9 -61.3 -51.9 1.4 35.0 -3.7 54 55 A K S S+ 0 0 145 -34,-0.1 2,-0.3 1,-0.1 -37,-0.3 0.515 129.9 21.5 -94.6 -11.5 -0.9 35.5 -0.7 55 56 A T - 0 0 70 -38,-0.1 -3,-2.6 -39,-0.1 2,-0.3 -0.973 54.3-158.1-152.9 160.0 1.3 34.1 2.1 56 57 A A E -CE 15 51A 3 -41,-1.6 -41,-2.3 -2,-0.3 2,-0.3 -0.964 5.5-164.0-141.4 162.3 4.8 33.1 3.3 57 58 A A E -CE 14 50A 18 -7,-2.4 -7,-2.7 -2,-0.3 -8,-2.5 -0.990 4.6-175.5-149.1 138.3 6.3 30.8 5.9 58 59 A A E -CE 13 48A 1 -45,-2.1 -45,-2.4 -2,-0.3 2,-0.5 -0.973 26.5-120.2-133.4 145.8 9.7 30.5 7.6 59 60 A K E -CE 12 47A 114 -12,-2.5 -12,-2.3 -2,-0.3 2,-0.3 -0.764 32.6-120.3 -86.9 126.8 11.2 28.0 10.0 60 61 A I E + E 0 46A 35 -49,-2.5 -14,-0.2 -2,-0.5 3,-0.1 -0.510 38.8 164.7 -73.2 131.7 12.4 29.5 13.3 61 62 A V E + 0 0 90 -16,-3.2 2,-0.3 1,-0.4 -15,-0.2 0.621 66.5 9.6-116.5 -33.5 16.1 29.1 13.9 62 63 A K E - E 0 45A 117 -17,-1.9 -17,-2.5 2,-0.0 -1,-0.4 -0.992 57.2-158.3-153.6 145.5 16.7 31.6 16.8 63 64 A V E - E 0 44A 73 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.2 -0.998 10.2-176.6-130.4 133.2 14.7 33.8 19.0 64 65 A E E - E 0 43A 85 -21,-2.7 -21,-3.1 -2,-0.4 2,-0.6 -1.000 24.6-132.4-131.1 126.9 15.9 36.9 20.8 65 66 A E E + E 0 42A 94 -2,-0.4 -23,-0.2 -23,-0.2 3,-0.1 -0.738 32.6 167.6 -78.3 121.4 14.0 39.1 23.2 66 67 A K + 0 0 89 -25,-3.2 2,-0.3 -2,-0.6 -24,-0.2 0.819 58.2 16.6-103.7 -42.2 14.6 42.7 22.1 67 68 A E - 0 0 58 -26,-1.6 -1,-0.3 65,-0.1 2,-0.2 -0.996 60.6-159.8-142.4 136.0 12.1 44.9 24.0 68 69 A K - 0 0 161 -2,-0.3 65,-0.1 -3,-0.1 -27,-0.1 -0.710 39.6 -84.9-112.0 169.0 10.0 44.4 27.2 69 70 A E - 0 0 124 -2,-0.2 2,-0.1 -29,-0.1 -1,-0.1 -0.464 51.8-121.2 -70.4 137.0 6.9 46.2 28.3 70 71 A P - 0 0 31 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.480 2.4-133.6 -81.1 158.2 7.9 49.4 30.3 71 72 A T S S+ 0 0 147 1,-0.2 2,-0.4 -2,-0.1 95,-0.1 0.935 98.1 41.8 -65.4 -45.8 6.9 50.0 33.9 72 73 A E S S- 0 0 78 93,-0.1 2,-0.3 -3,-0.0 -1,-0.2 -0.877 85.8-144.4-113.6 126.9 5.9 53.6 33.1 73 74 A K - 0 0 66 -2,-0.4 94,-2.0 -3,-0.1 2,-0.5 -0.714 9.1-151.3 -99.1 149.6 3.9 54.2 29.9 74 75 A L E -g 167 0C 0 -2,-0.3 25,-3.1 23,-0.2 26,-1.4 -0.978 23.3-178.4-116.1 114.3 3.9 57.1 27.5 75 76 A S E -gh 168 100C 14 92,-2.6 94,-2.2 -2,-0.5 2,-0.4 -0.885 8.4-163.7-113.5 146.8 0.5 57.5 25.7 76 77 A V E -gh 169 101C 3 24,-1.9 26,-2.2 -2,-0.3 2,-0.7 -1.000 14.5-143.4-132.7 130.4 -0.4 60.1 23.1 77 78 A V E -gh 170 102C 0 92,-3.1 94,-2.0 -2,-0.4 26,-0.2 -0.887 23.6-160.8 -91.1 116.3 -3.8 61.2 21.9 78 79 A V E - 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