==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 22-FEB-08 3CBN . COMPND 2 MOLECULE: CONSERVED PROTEIN MTH639; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR L.SATYANARAYANA,S.ESWARAMOORTHY,S.K.BURLEY,S.SWAMINATHAN,NEW . 144 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 25.7 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 . 5 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 7.6 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+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 1 1 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 . 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 0 PARALLEL BRIDGES PER LADDER . 2 0 0 0 1 0 2 0 0 1 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 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 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 21 A L 0 0 137 0, 0.0 2,-0.3 0, 0.0 141,-0.2 0.000 360.0 360.0 360.0 140.9 10.9 19.5 3.6 2 22 A G E -A 141 0A 20 139,-2.7 139,-2.1 56,-0.1 2,-0.4 -0.804 360.0-149.2-119.9 163.5 12.9 20.8 6.6 3 23 A V E -A 140 0A 82 -2,-0.3 2,-0.4 137,-0.2 137,-0.2 -0.995 12.2-175.1-137.6 128.7 14.9 18.9 9.1 4 24 A L E -A 139 0A 34 135,-2.4 135,-2.4 -2,-0.4 2,-0.3 -0.979 3.3-166.8-126.7 138.8 15.5 19.9 12.7 5 25 A R E +A 138 0A 137 -2,-0.4 2,-0.3 133,-0.2 133,-0.2 -0.909 9.5 170.2-123.7 152.4 17.7 18.2 15.3 6 26 A Y E -A 137 0A 66 131,-1.5 131,-3.2 -2,-0.3 2,-0.4 -0.944 14.8-155.4-159.7 136.7 18.0 18.6 19.1 7 27 A T E -A 136 0A 59 -2,-0.3 2,-0.3 129,-0.2 129,-0.2 -0.951 12.2-179.8-119.5 136.1 19.9 16.7 21.8 8 28 A L E -A 135 0A 1 127,-2.6 127,-2.8 -2,-0.4 2,-0.3 -0.842 18.7-129.3-126.1 165.2 19.0 16.5 25.5 9 29 A R E +A 134 0A 139 -2,-0.3 36,-2.9 125,-0.2 37,-0.4 -0.875 31.0 149.6-120.9 151.7 20.6 14.7 28.4 10 30 A A E -A 133 0A 8 123,-2.2 123,-3.4 -2,-0.3 2,-0.3 -0.894 29.1-127.2-158.3-177.8 19.4 12.3 31.1 11 31 A R E -AB 132 42A 128 31,-2.3 31,-2.9 121,-0.3 121,-0.2 -0.970 20.8-107.6-142.8 157.8 20.8 9.5 33.1 12 32 A G - 0 0 3 119,-2.7 116,-0.2 -2,-0.3 115,-0.1 0.001 27.6-149.0 -71.1-174.7 19.8 5.9 34.0 13 33 A H > - 0 0 14 114,-1.0 3,-2.0 27,-0.1 117,-0.2 -0.973 26.2-115.4-156.6 146.0 18.5 4.7 37.3 14 34 A P T 3 S+ 0 0 97 0, 0.0 114,-0.1 0, 0.0 -1,-0.0 0.764 114.5 57.1 -56.3 -25.2 18.8 1.4 39.2 15 35 A N T 3 S+ 0 0 64 17,-0.1 2,-0.4 -3,-0.0 21,-0.1 0.327 75.8 119.9 -90.4 7.3 15.0 0.9 38.9 16 36 A V < + 0 0 1 -3,-2.0 21,-0.1 111,-0.2 24,-0.1 -0.598 21.8 156.5 -74.5 128.5 14.9 1.1 35.1 17 37 A T - 0 0 60 22,-0.4 -1,-0.2 -2,-0.4 20,-0.1 0.578 32.5-152.3-121.2 -27.7 13.5 -2.1 33.6 18 38 A A + 0 0 7 21,-0.5 101,-0.2 18,-0.3 20,-0.2 0.924 47.4 137.5 51.8 49.8 12.2 -0.8 30.3 19 39 A G + 0 0 30 18,-0.8 19,-0.2 20,-0.1 -1,-0.1 0.532 22.2 122.6-101.5 -7.6 9.6 -3.5 30.1 20 40 A H - 0 0 54 17,-2.3 97,-2.9 1,-0.1 98,-0.2 -0.332 49.6-154.4 -60.3 131.8 6.6 -1.4 28.9 21 41 A R S S+ 0 0 163 95,-0.2 -1,-0.1 1,-0.2 94,-0.1 0.568 84.6 29.7 -85.8 -11.8 5.2 -2.8 25.6 22 42 A T S S+ 0 0 69 1,-0.2 77,-2.4 92,-0.1 78,-0.5 0.436 118.3 22.5-129.2 0.7 3.7 0.4 24.1 23 43 A T E -F 98 0B 9 75,-0.2 93,-2.0 76,-0.1 2,-0.3 -0.968 47.8-157.2-156.8 169.2 5.8 3.4 25.3 24 44 A F E -F 97 0B 6 73,-1.3 73,-2.4 -2,-0.3 2,-0.3 -0.962 20.7-161.7-149.8 146.3 9.1 4.7 26.7 25 45 A E E -Fg 96 39B 26 13,-3.0 15,-3.0 -2,-0.3 16,-1.0 -0.974 17.7-160.2-141.0 152.0 9.6 7.8 28.7 26 46 A V E -Fg 95 41B 7 69,-2.2 69,-2.1 -2,-0.3 2,-0.3 -0.933 22.3-169.8-122.0 144.0 12.3 10.3 29.8 27 47 A T E -F 94 0B 2 14,-2.1 17,-2.3 -2,-0.3 67,-0.2 -0.983 34.7-139.5-140.8 152.5 11.7 12.6 32.8 28 48 A V S S+ 0 0 46 65,-2.0 66,-0.1 -2,-0.3 14,-0.1 0.664 78.4 105.7 -79.2 -16.7 13.2 15.6 34.5 29 49 A D - 0 0 71 64,-0.2 14,-2.6 1,-0.1 15,-0.3 -0.358 69.2-143.7 -61.4 141.1 12.3 14.0 37.8 30 50 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.734 75.9 45.5 -82.8 -21.4 15.5 12.5 39.5 31 51 A E - 0 0 128 -18,-0.1 2,-0.3 11,-0.0 12,-0.1 -0.911 60.9-166.8-125.2 151.4 13.9 9.4 41.0 32 52 A I - 0 0 14 -2,-0.3 -17,-0.1 1,-0.1 10,-0.0 -0.972 21.7-116.7-134.3 149.9 11.6 6.7 39.8 33 53 A G > - 0 0 43 -2,-0.3 3,-0.6 1,-0.1 -1,-0.1 -0.021 33.6-100.9 -74.5-176.8 9.6 4.0 41.5 34 54 A E T 3 S+ 0 0 83 1,-0.2 -1,-0.1 -18,-0.0 -2,-0.0 0.636 119.7 52.1 -81.1 -14.2 9.9 0.2 41.2 35 55 A T T 3 S+ 0 0 131 1,-0.1 2,-1.9 2,-0.0 -1,-0.2 0.338 73.1 106.5-105.0 6.3 6.9 0.0 38.9 36 56 A A X + 0 0 22 -3,-0.6 3,-1.4 1,-0.2 -19,-0.3 -0.424 36.6 159.7 -84.3 64.9 7.9 2.7 36.3 37 57 A D T 3 + 0 0 61 -2,-1.9 -17,-2.3 1,-0.2 -18,-0.8 0.430 66.9 57.5 -69.4 1.5 8.7 0.2 33.6 38 58 A C T 3 S+ 0 0 19 -19,-0.2 -13,-3.0 -20,-0.2 2,-0.4 0.591 83.5 96.8-105.1 -14.2 8.3 2.7 30.8 39 59 A I E < +g 25 0B 17 -3,-1.4 -21,-0.5 -15,-0.2 -22,-0.4 -0.632 34.9 164.0 -82.5 127.4 11.0 5.2 32.1 40 60 A I E + 0 0 0 -15,-3.0 2,-0.3 -2,-0.4 -14,-0.2 0.411 65.8 36.1-118.4 -4.8 14.4 4.8 30.6 41 61 A G E -g 26 0B 0 -16,-1.0 -14,-2.1 -29,-0.1 -1,-0.3 -0.974 57.7-176.1-154.8 137.3 15.9 8.2 31.7 42 62 A V B +B 11 0A 0 -31,-2.9 -31,-2.3 -2,-0.3 -14,-0.2 -0.728 66.2 37.4-122.8 173.3 15.7 10.5 34.7 43 63 A S S S- 0 0 42 -14,-2.6 -15,-0.3 -2,-0.2 -1,-0.2 0.876 78.9-172.7 50.3 42.6 17.1 13.9 35.5 44 64 A S - 0 0 10 -17,-2.3 -34,-0.3 -15,-0.3 -1,-0.1 -0.347 31.3-137.5 -66.9 144.5 16.5 15.0 32.0 45 65 A S S S+ 0 0 73 -36,-2.9 2,-0.3 1,-0.1 -1,-0.1 0.422 89.3 42.3 -81.2 1.6 17.9 18.4 30.9 46 66 A D - 0 0 16 -37,-0.4 2,-0.2 47,-0.1 -2,-0.1 -0.999 61.1-158.7-151.0 146.1 14.6 18.9 29.1 47 67 A S > - 0 0 4 -2,-0.3 3,-0.8 -20,-0.1 4,-0.4 -0.618 48.5-100.2-107.2 171.8 10.9 18.3 29.5 48 68 A I G > S+ 0 0 0 46,-1.3 3,-1.0 43,-0.3 47,-0.1 0.883 124.4 58.4 -64.5 -30.5 8.7 18.1 26.4 49 69 A S G 3 S+ 0 0 34 42,-1.6 -1,-0.2 1,-0.2 7,-0.1 0.740 100.2 54.9 -69.5 -24.6 7.8 21.7 27.1 50 70 A T G < S+ 0 0 75 -3,-0.8 -1,-0.2 2,-0.0 -2,-0.2 0.432 78.0 114.0 -92.8 2.2 11.4 23.1 27.0 51 71 A L S < S- 0 0 3 -3,-1.0 5,-0.1 -4,-0.4 -45,-0.0 -0.294 87.0 -73.9 -64.9 158.9 12.3 21.8 23.6 52 72 A P >> - 0 0 50 0, 0.0 4,-2.4 0, 0.0 3,-0.6 -0.267 37.5-129.3 -57.5 138.3 12.9 24.6 21.0 53 73 A D H 3> S+ 0 0 102 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.851 108.7 57.3 -58.5 -35.9 9.7 26.3 19.8 54 74 A E H 3> S+ 0 0 104 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.870 109.6 45.5 -64.1 -35.2 10.7 25.8 16.2 55 75 A X H <> S+ 0 0 3 -3,-0.6 4,-2.6 2,-0.2 -2,-0.2 0.898 110.0 53.2 -74.1 -40.1 10.9 22.1 16.8 56 76 A K H X S+ 0 0 45 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.893 110.2 48.8 -61.4 -37.6 7.6 22.0 18.7 57 77 A R H < S+ 0 0 146 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.891 112.1 48.7 -67.7 -39.8 5.9 23.7 15.8 58 78 A A H < S+ 0 0 1 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.871 111.8 48.4 -67.6 -40.3 7.5 21.3 13.3 59 79 A I H < S+ 0 0 0 -4,-2.6 2,-2.0 1,-0.2 25,-0.8 0.913 99.4 69.1 -68.2 -43.5 6.4 18.2 15.3 60 80 A A S < S+ 0 0 20 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 -0.440 86.6 81.7 -80.2 70.9 2.8 19.3 15.8 61 81 A R 0 0 19 -2,-2.0 22,-0.1 -3,-0.2 25,-0.1 -0.983 360.0 360.0-163.1 163.6 1.5 19.0 12.2 62 82 A E 0 0 142 -2,-0.3 80,-0.3 22,-0.2 22,-0.1 -0.324 360.0 360.0 -58.6 360.0 0.2 16.5 9.7 63 ! 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 64 84 A S 0 0 21 0, 0.0 19,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 152.9 5.8 15.3 10.2 65 85 A L E -CD 82 140A 80 75,-2.9 75,-1.9 17,-0.2 2,-0.5 -0.904 360.0-161.1-110.5 136.7 8.2 12.4 11.0 66 86 A V E -CD 81 139A 2 15,-1.8 15,-3.3 -2,-0.4 2,-0.4 -0.974 8.3-177.7-121.5 129.6 9.8 12.1 14.4 67 87 A R E -CD 80 138A 61 71,-3.2 71,-3.2 -2,-0.5 2,-0.4 -0.986 6.5-163.8-127.0 135.9 12.9 10.0 15.0 68 88 A V E -CD 79 137A 2 11,-2.8 11,-3.2 -2,-0.4 2,-0.5 -0.973 2.3-162.7-121.7 131.9 14.7 9.5 18.3 69 89 A I E -CD 78 136A 6 67,-2.4 67,-2.4 -2,-0.4 2,-0.4 -0.966 9.0-159.5-114.4 123.0 18.2 8.1 18.7 70 90 A L E +CD 77 135A 0 7,-3.1 7,-2.0 -2,-0.5 2,-0.4 -0.864 14.0 178.7-104.5 134.4 19.1 6.8 22.2 71 91 A R E +CD 76 134A 97 63,-2.0 63,-2.9 -2,-0.4 2,-0.3 -0.998 15.2 165.6-141.7 139.0 22.8 6.5 23.2 72 92 A T - 0 0 16 3,-2.2 3,-0.5 -2,-0.4 61,-0.1 -0.788 60.0 -84.3-132.5 174.1 24.8 5.4 26.2 73 93 A E S S+ 0 0 132 59,-0.4 50,-0.1 -2,-0.3 60,-0.1 0.854 129.2 15.2 -53.7 -36.3 28.5 4.6 26.3 74 94 A N S S+ 0 0 89 48,-0.2 2,-0.3 49,-0.1 -1,-0.2 0.267 119.9 75.0-120.3 9.3 27.9 1.0 25.2 75 95 A G + 0 0 8 -3,-0.5 -3,-2.2 47,-0.1 2,-0.3 -0.899 45.4 169.6-128.8 157.1 24.3 1.2 24.0 76 96 A Y E +C 71 0A 109 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.969 2.8 161.5-161.7 141.6 22.4 2.5 21.0 77 97 A D E -C 70 0A 14 -7,-2.0 -7,-3.1 -2,-0.3 2,-0.4 -0.981 20.6-146.5-159.8 154.4 18.9 2.4 19.5 78 98 A E E -C 69 0A 41 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.988 9.8-166.6-128.6 132.8 16.7 4.3 17.0 79 99 A I E -C 68 0A 0 -11,-3.2 -11,-2.8 -2,-0.4 2,-0.5 -0.972 5.2-158.9-121.5 133.6 13.0 4.8 17.2 80 100 A R E +C 67 0A 133 -2,-0.4 33,-1.4 -13,-0.2 -13,-0.2 -0.942 26.9 139.7-115.3 128.8 10.9 6.1 14.2 81 101 A G E -C 66 0A 4 -15,-3.3 -15,-1.8 -2,-0.5 2,-0.3 -0.695 39.4 -98.8-145.4-162.3 7.5 7.6 14.7 82 102 A Y E -CE 65 110A 93 28,-2.3 28,-2.4 -17,-0.3 -17,-0.2 -0.908 17.7-133.6-132.1 157.0 5.1 10.4 13.6 83 103 A G - 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