==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 11-JAN-96 1MPM . COMPND 2 MOLECULE: MALTOPORIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.DUTZLER,T.SCHIRMER . 1263 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47411.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 948 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 687 54.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 12 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 1.2 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 . 135 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.2 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 0 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 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 0 PARALLEL BRIDGES PER LADDER . 9 0 12 0 6 6 6 3 6 6 6 6 9 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 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 V 0 0 48 0, 0.0 2,-0.5 0, 0.0 47,-0.2 0.000 360.0 360.0 360.0 136.6 -0.1 40.4 66.0 2 2 A D E -A 47 0A 62 45,-3.4 45,-2.4 2,-0.0 2,-0.5 -0.853 360.0-157.7 -93.0 131.0 3.6 40.2 66.9 3 3 A F E +A 46 0A 8 -2,-0.5 2,-0.3 43,-0.2 43,-0.2 -0.936 26.3 149.8-110.2 118.5 4.3 37.6 69.5 4 4 A H E +A 45 0A 78 41,-2.9 41,-3.8 -2,-0.5 2,-0.3 -0.934 5.9 114.9-138.5 175.2 7.5 38.0 71.5 5 5 A G E -A 44 0A 10 416,-1.4 416,-1.3 -2,-0.3 2,-0.3 -0.990 46.5 -95.4 162.0-159.9 8.8 37.2 74.9 6 6 A Y E +AB 43 420A 29 37,-1.6 37,-2.8 -2,-0.3 2,-0.3 -0.965 33.4 168.6-154.8 146.6 11.3 35.3 77.2 7 7 A A E -AB 42 419A 0 412,-2.0 412,-2.4 -2,-0.3 2,-0.3 -0.970 12.8-178.1-164.1 145.2 11.0 32.1 79.0 8 8 A R E +AB 41 418A 20 33,-1.5 33,-1.3 -2,-0.3 2,-0.3 -0.949 16.6 159.3-142.7 143.1 13.2 29.5 80.9 9 9 A S E + B 0 417A 0 408,-1.7 408,-2.5 -2,-0.3 2,-0.2 -0.897 7.0 136.7-165.8 141.9 11.9 26.3 82.4 10 10 A G E - B 0 416A 3 -2,-0.3 2,-0.3 406,-0.2 406,-0.2 -0.867 42.0-102.3-165.4-167.4 13.5 23.0 83.5 11 11 A I E + B 0 415A 4 404,-2.0 404,-1.7 -2,-0.2 2,-0.3 -0.975 38.1 176.1-137.0 141.7 13.8 20.1 86.0 12 12 A G E - B 0 414A 2 -2,-0.3 8,-0.8 402,-0.2 2,-0.3 -0.981 19.2-149.7-151.2 163.5 16.6 19.7 88.4 13 13 A W E -CB 19 413A 37 400,-2.5 400,-1.8 -2,-0.3 2,-0.4 -0.976 17.5-130.4-134.8 145.4 18.1 17.7 91.3 14 14 A T E > - B 0 412A 5 4,-2.6 3,-1.3 -2,-0.3 398,-0.3 -0.808 20.4-131.6 -97.8 133.2 20.3 18.5 94.3 15 15 A G T 3 S+ 0 0 27 396,-4.0 -1,-0.1 -2,-0.4 3,-0.1 0.944 108.2 43.1 -45.0 -55.4 23.3 16.2 94.8 16 16 A S T 3 S- 0 0 40 395,-0.3 -1,-0.3 1,-0.2 1029,-0.2 0.526 130.9 -64.2 -70.3 -9.8 22.5 15.7 98.6 17 17 A G S < S+ 0 0 9 -3,-1.3 1027,-0.6 1,-0.3 -1,-0.2 -0.353 85.9 32.1 136.5 146.9 18.8 15.3 97.9 18 18 A G S S- 0 0 1 1024,-0.3 -4,-2.6 1025,-0.2 -1,-0.3 -0.104 89.3 -13.0 79.8-175.2 15.6 16.9 96.7 19 19 A E B S-C 13 0A 63 1022,-0.3 -6,-0.3 -6,-0.2 -2,-0.1 -0.086 88.5 -75.7 -57.4 159.4 14.7 19.5 94.1 20 20 A Q - 0 0 18 -8,-0.8 2,-0.3 -7,-0.1 -1,-0.2 -0.338 48.0-153.5 -58.3 139.9 17.4 21.6 92.5 21 21 A Q - 0 0 56 -8,-0.2 2,-0.3 -3,-0.1 -8,-0.1 -0.861 5.4-140.8-112.7 155.8 18.8 24.4 94.8 22 22 A a - 0 0 40 -2,-0.3 2,-0.6 14,-0.1 14,-0.1 -0.841 10.1-135.5-117.7 156.0 20.3 27.6 93.5 23 23 A F + 0 0 2 -2,-0.3 2,-0.4 9,-0.2 9,-0.3 -0.875 27.9 158.2-123.5 114.2 23.3 29.5 94.9 24 24 A Q - 0 0 78 -2,-0.6 2,-0.3 7,-0.1 7,-0.1 -0.962 41.1-113.5-128.2 138.8 23.8 33.2 95.5 25 25 A T > - 0 0 2 5,-0.4 3,-2.7 -2,-0.4 5,-0.2 -0.532 36.5-107.9 -70.7 133.3 26.2 34.8 97.9 26 26 A T T 3 S+ 0 0 32 1,-0.3 314,-0.2 -2,-0.3 305,-0.1 -0.346 110.6 21.0 -61.2 123.6 24.7 36.7 100.9 27 27 A G T 3 S+ 0 0 17 1,-0.4 -1,-0.3 -2,-0.1 2,-0.3 0.125 98.8 116.4 100.5 -22.4 25.1 40.4 100.1 28 28 A A < - 0 0 8 -3,-2.7 -1,-0.4 1,-0.1 303,-0.1 -0.611 60.7-146.2 -80.3 140.1 25.6 39.8 96.4 29 29 A Q S S+ 0 0 68 -2,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.275 77.3 14.7 -86.8 12.3 22.9 41.3 94.2 30 30 A S - 0 0 7 -5,-0.2 -5,-0.4 87,-0.1 2,-0.3 -0.955 62.3-137.3-167.6 174.1 23.0 38.4 91.7 31 31 A K - 0 0 35 84,-0.6 2,-0.7 -2,-0.3 -7,-0.1 -0.900 39.5 -95.5-137.5 161.4 24.2 34.9 90.9 32 32 A Y - 0 0 3 -9,-0.3 83,-0.2 -2,-0.3 -9,-0.2 -0.814 41.7-151.6 -81.4 116.5 25.8 33.3 87.8 33 33 A R > + 0 0 9 81,-2.1 3,-2.4 -2,-0.7 -1,-0.1 0.658 55.4 110.3 -63.9 -35.4 22.8 31.8 86.0 34 34 A L T 3 S- 0 0 2 80,-0.4 291,-0.1 1,-0.3 -2,-0.1 -0.319 106.6 -11.7 -54.8 121.6 24.0 28.8 84.0 35 35 A G T 3 S+ 0 0 1 1,-0.1 -1,-0.3 311,-0.1 377,-0.1 0.858 122.2 92.8 58.7 35.3 22.5 25.7 85.7 36 36 A N < + 0 0 1 -3,-2.4 2,-0.5 -14,-0.1 -2,-0.1 -0.161 51.2 108.1-150.3 35.4 21.6 28.0 88.6 37 37 A E - 0 0 7 -16,-0.1 -17,-0.1 -15,-0.1 -2,-0.0 -0.990 39.5-175.8-122.3 126.4 18.0 29.0 87.9 38 38 A a + 0 0 38 -2,-0.5 2,-0.3 -29,-0.0 -16,-0.1 0.056 55.1 58.7-113.2 23.4 15.3 27.6 90.0 39 39 A E S S- 0 0 46 2,-0.0 2,-0.6 32,-0.0 30,-0.2 -0.948 75.3-115.5-141.8 166.4 12.0 28.9 88.6 40 40 A T E + D 0 68A 0 28,-2.3 28,-2.2 -2,-0.3 2,-0.4 -0.929 42.0 179.4 -97.9 119.9 10.0 28.9 85.4 41 41 A Y E +AD 8 67A 27 -33,-1.3 -33,-1.5 -2,-0.6 2,-0.3 -0.991 3.2 171.3-123.6 136.9 9.8 32.5 84.3 42 42 A A E -AD 7 66A 0 24,-2.3 24,-2.7 -2,-0.4 2,-0.5 -0.991 22.6-162.5-149.5 137.2 8.1 33.7 81.2 43 43 A E E -AD 6 65A 20 -37,-2.8 -37,-1.6 -2,-0.3 2,-0.6 -0.994 13.2-162.0-115.4 120.7 7.1 37.1 79.6 44 44 A L E -AD 5 64A 17 20,-2.5 20,-1.4 -2,-0.5 2,-0.4 -0.924 10.5-170.1-104.8 108.1 4.4 36.8 76.8 45 45 A K E +A 4 0A 29 -41,-3.8 -41,-2.9 -2,-0.6 2,-0.5 -0.847 11.8 179.5-102.9 130.4 4.4 39.9 74.6 46 46 A L E +A 3 0A 14 -2,-0.4 16,-0.5 -43,-0.2 2,-0.3 -0.984 20.6 155.3-124.8 112.8 1.7 40.6 72.1 47 47 A G E -A 2 0A 1 -45,-2.4 -45,-3.4 -2,-0.5 2,-0.3 -0.789 19.0-166.1-129.6-179.4 2.1 43.8 70.2 48 48 A Q E -E 60 0A 48 12,-2.7 12,-2.6 -2,-0.3 2,-0.8 -0.899 30.2-120.5-170.9 138.5 1.1 45.3 66.9 49 49 A E E -E 59 0A 90 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.738 36.6-176.5 -78.0 110.9 1.8 48.2 64.5 50 50 A V E + 0 0 41 8,-2.0 2,-0.3 -2,-0.8 -1,-0.2 0.606 57.2 13.4 -93.0 -11.4 -1.7 49.7 64.5 51 51 A W E +E 58 0A 38 7,-1.1 7,-1.9 725,-0.0 2,-0.3 -0.948 58.8 176.0-163.1 137.4 -1.4 52.5 62.0 52 52 A K E +E 57 0A 109 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.985 8.5 173.1-148.6 135.1 1.1 53.5 59.5 53 53 A E E > -E 56 0A 122 3,-2.8 3,-1.8 -2,-0.3 2,-0.6 -0.755 68.6 -60.2-144.2 94.0 1.2 56.3 56.9 54 54 A G T 3 S- 0 0 64 1,-0.3 -1,-0.0 -2,-0.3 0, 0.0 -0.585 125.5 -3.3 75.6-119.1 4.4 56.6 55.1 55 55 A D T 3 S+ 0 0 120 -2,-0.6 2,-0.4 35,-0.1 -1,-0.3 0.600 120.1 89.1 -78.7 -23.9 7.1 57.3 57.7 56 56 A K E < +E 53 0A 53 -3,-1.8 -3,-2.8 34,-0.1 2,-0.3 -0.724 48.9 160.2 -91.0 133.1 4.6 57.5 60.5 57 57 A S E -EF 52 89A 7 32,-1.3 32,-1.6 -2,-0.4 2,-0.4 -0.931 30.4-145.4-144.8 163.8 3.5 54.7 62.7 58 58 A F E -EF 51 88A 0 -7,-1.9 -8,-2.0 -2,-0.3 -7,-1.1 -0.999 21.0-166.3-126.6 121.6 1.8 53.8 66.0 59 59 A Y E -EF 49 87A 34 28,-2.9 28,-2.6 -2,-0.4 2,-0.5 -0.938 4.6-158.0-111.6 138.3 3.0 50.7 67.7 60 60 A F E -EF 48 86A 0 -12,-2.6 -12,-2.7 -2,-0.4 2,-0.3 -0.976 15.0-179.5-117.1 126.5 1.1 49.0 70.6 61 61 A D E + F 0 85A 20 24,-2.1 24,-2.0 -2,-0.5 2,-0.3 -0.956 6.2 180.0-130.5 140.0 3.0 46.7 72.9 62 62 A T E - F 0 84A 1 -16,-0.5 2,-0.3 -2,-0.3 22,-0.3 -0.862 7.3-164.6-129.8 169.9 2.0 44.6 76.0 63 63 A N E - F 0 83A 0 20,-1.9 20,-1.5 -2,-0.3 19,-1.0 -0.872 4.8-174.9-159.9 121.9 3.8 42.2 78.4 64 64 A V E -DF 44 81A 6 -20,-1.4 -20,-2.5 -2,-0.3 2,-0.3 -0.992 18.0-157.2-120.6 119.0 2.3 39.7 80.9 65 65 A A E -DF 43 80A 0 15,-2.3 15,-2.0 -2,-0.5 2,-0.4 -0.743 8.2-168.2-104.1 145.3 4.9 37.9 83.1 66 66 A Y E -D 42 0A 7 -24,-2.7 -24,-2.3 -2,-0.3 2,-0.4 -0.993 6.8-178.1-131.1 138.8 4.6 34.6 85.0 67 67 A S E +D 41 0A 49 -2,-0.4 2,-0.3 -26,-0.2 11,-0.2 -0.996 14.0 166.1-137.4 116.3 6.9 33.1 87.6 68 68 A V E -D 40 0A 10 -28,-2.2 -28,-2.3 -2,-0.4 9,-0.1 -0.913 42.3-119.9-130.2 161.6 6.1 29.7 89.0 69 69 A A - 0 0 57 -2,-0.3 -28,-0.1 -30,-0.2 -1,-0.0 0.564 36.1-136.3 -77.1 -17.5 8.1 27.2 91.1 70 70 A Q + 0 0 9 2,-0.1 3,-0.1 -30,-0.1 -60,-0.0 0.936 69.7 116.2 58.6 56.8 8.0 24.4 88.6 71 71 A Q S S+ 0 0 10 1,-0.3 2,-0.3 920,-0.1 942,-0.2 0.379 77.3 23.1-126.1 -6.8 7.3 21.6 91.0 72 72 A N S S- 0 0 45 918,-0.2 -1,-0.3 1,-0.2 -2,-0.1 -0.954 71.9-118.9-150.2 169.9 3.9 20.7 89.6 73 73 A D S S+ 0 0 22 894,-0.3 2,-1.0 -2,-0.3 -1,-0.2 0.981 103.4 52.0 -74.6 -65.8 1.8 20.9 86.5 74 74 A W + 0 0 113 850,-0.1 2,-0.5 1,-0.0 -1,-0.2 -0.543 68.4 162.7 -76.3 102.7 -1.1 23.1 87.8 75 75 A E - 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