==== 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 1MPO . 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) . 47614.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 944 74.7 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 . 684 54.2 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 . 141 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 0.7 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 . 6 3 9 3 6 6 6 3 6 9 3 9 9 0 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 0 3 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 51 0, 0.0 2,-0.4 0, 0.0 47,-0.2 0.000 360.0 360.0 360.0 145.4 -0.2 40.2 66.1 2 2 A D E -A 47 0A 65 45,-3.2 45,-1.6 2,-0.0 2,-0.5 -0.804 360.0-157.5 -92.9 140.5 3.5 40.2 67.0 3 3 A F E +A 46 0A 9 -2,-0.4 2,-0.3 43,-0.2 43,-0.2 -0.978 25.2 149.5-124.5 115.2 4.4 37.5 69.5 4 4 A H E +A 45 0A 76 41,-1.8 41,-4.0 -2,-0.5 2,-0.3 -0.915 7.8 116.4-134.4 171.8 7.6 38.0 71.5 5 5 A G E -A 44 0A 12 416,-1.1 416,-1.2 -2,-0.3 2,-0.3 -0.948 45.2-102.1 168.4-153.3 8.8 37.0 74.9 6 6 A Y E +AB 43 420A 29 37,-1.5 37,-2.2 -2,-0.3 2,-0.3 -0.928 31.7 170.1-162.6 150.4 11.4 35.1 77.1 7 7 A A E -AB 42 419A 0 412,-1.8 412,-2.2 -2,-0.3 2,-0.3 -0.962 13.4-177.2-166.7 151.2 11.0 31.9 79.0 8 8 A R E +AB 41 418A 21 33,-1.4 33,-1.3 -2,-0.3 2,-0.3 -0.899 17.1 158.4-150.9 137.6 13.2 29.3 80.9 9 9 A S E + B 0 417A 0 408,-1.3 408,-2.3 -2,-0.3 2,-0.3 -0.921 9.7 133.5-160.0 150.6 11.8 26.2 82.4 10 10 A G E - B 0 416A 2 -2,-0.3 2,-0.3 406,-0.2 406,-0.2 -0.921 43.4-101.9-176.3-167.5 13.4 22.9 83.3 11 11 A I E + B 0 415A 3 404,-2.2 404,-1.7 -2,-0.3 2,-0.3 -0.984 35.3 178.2-143.0 138.8 13.9 20.1 85.9 12 12 A G E - B 0 414A 3 -2,-0.3 8,-0.8 402,-0.2 2,-0.3 -0.893 16.5-148.0-141.1 170.6 16.8 19.7 88.3 13 13 A W E -CB 19 413A 40 400,-2.0 400,-1.6 6,-0.3 2,-0.5 -0.980 18.5-126.5-138.1 145.4 18.2 17.5 91.1 14 14 A T E > - B 0 412A 6 4,-2.6 3,-1.1 -2,-0.3 398,-0.3 -0.826 17.0-135.4 -97.4 130.7 20.5 18.2 94.1 15 15 A G T 3 S+ 0 0 24 396,-4.3 -1,-0.2 -2,-0.5 397,-0.1 0.953 108.4 41.6 -43.6 -55.5 23.5 16.0 94.5 16 16 A S T 3 S- 0 0 44 395,-0.4 -1,-0.3 1,-0.2 1029,-0.2 0.566 130.6 -60.8 -69.9 -14.1 22.8 15.6 98.2 17 17 A G S < S+ 0 0 11 -3,-1.1 1027,-0.5 1,-0.3 -1,-0.2 -0.449 87.5 27.5 142.2 149.6 19.0 15.1 97.8 18 18 A G S S- 0 0 1 1024,-0.4 -4,-2.6 1025,-0.2 -1,-0.3 0.043 92.2 -15.5 69.6-175.0 15.6 16.5 96.6 19 19 A E B S-C 13 0A 40 1022,-0.3 -6,-0.3 -6,-0.2 -2,-0.0 -0.040 86.7 -73.1 -60.0 164.9 15.0 19.1 93.9 20 20 A Q - 0 0 16 -8,-0.8 2,-0.3 393,-0.1 -6,-0.2 -0.237 46.5-155.8 -59.7 139.5 17.5 21.3 92.4 21 21 A Q - 0 0 51 -8,-0.2 2,-0.3 -3,-0.1 -8,-0.1 -0.886 6.9-136.5-114.6 154.7 18.8 24.2 94.5 22 22 A a - 0 0 40 -2,-0.3 2,-0.6 14,-0.1 14,-0.1 -0.734 13.3-135.9-111.9 149.9 20.4 27.4 93.3 23 23 A F + 0 0 3 -2,-0.3 2,-0.4 9,-0.2 9,-0.3 -0.874 27.1 161.6-117.3 120.0 23.5 29.1 94.8 24 24 A Q - 0 0 80 -2,-0.6 7,-0.1 7,-0.1 2,-0.1 -0.977 39.0-115.6-136.5 127.6 23.9 32.8 95.5 25 25 A T > - 0 0 1 -2,-0.4 3,-2.7 5,-0.3 5,-0.2 -0.354 38.1-110.4 -59.7 129.2 26.5 34.5 97.7 26 26 A T T 3 S+ 0 0 30 1,-0.3 305,-0.2 -2,-0.1 314,-0.1 -0.376 108.3 20.3 -61.2 123.7 24.9 36.3 100.7 27 27 A G T 3 S+ 0 0 19 1,-0.4 -1,-0.3 -2,-0.2 2,-0.2 0.113 98.3 115.7 99.8 -24.9 25.3 40.0 100.1 28 28 A A < - 0 0 9 -3,-2.7 -1,-0.4 1,-0.1 303,-0.1 -0.577 61.1-145.4 -76.8 143.7 25.8 39.5 96.3 29 29 A Q S S+ 0 0 69 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.337 78.3 19.9 -89.3 6.3 23.0 41.0 94.1 30 30 A S - 0 0 7 -5,-0.2 2,-0.3 87,-0.1 -5,-0.3 -0.889 63.3-143.4-156.5 177.3 23.2 38.2 91.5 31 31 A K - 0 0 37 84,-0.6 2,-0.8 -2,-0.3 -7,-0.1 -0.932 40.3 -91.1-144.5 160.1 24.4 34.6 90.9 32 32 A Y - 0 0 3 -9,-0.3 83,-0.2 -2,-0.3 -9,-0.2 -0.737 42.6-153.5 -77.5 115.2 26.0 33.0 87.8 33 33 A R > + 0 0 8 81,-1.9 3,-2.0 -2,-0.8 -1,-0.1 0.715 54.9 106.8 -66.7 -29.8 23.0 31.6 86.0 34 34 A L T 3 S- 0 0 1 80,-0.3 291,-0.1 1,-0.3 -2,-0.1 -0.269 106.6 -8.9 -61.9 118.7 24.0 28.6 83.9 35 35 A G T 3 S+ 0 0 1 -2,-0.1 -1,-0.3 1,-0.1 377,-0.1 0.877 122.8 88.8 63.3 39.4 22.7 25.5 85.6 36 36 A N < + 0 0 0 -3,-2.0 2,-0.4 -14,-0.1 -2,-0.1 -0.122 52.3 107.0-158.5 32.8 21.7 27.7 88.5 37 37 A E - 0 0 8 -15,-0.1 -17,-0.0 -16,-0.1 -28,-0.0 -0.992 40.0-174.8-120.8 130.9 18.1 28.9 87.8 38 38 A a + 0 0 37 -2,-0.4 2,-0.3 2,-0.0 -26,-0.1 0.065 53.1 67.0-115.0 22.0 15.3 27.4 89.8 39 39 A E S S- 0 0 43 2,-0.0 2,-0.6 -30,-0.0 30,-0.2 -0.906 73.5-120.8-133.1 169.3 12.0 28.8 88.5 40 40 A T E + D 0 68A 0 28,-2.2 28,-2.3 -2,-0.3 2,-0.4 -0.973 42.8 178.8-105.6 117.1 10.0 28.7 85.3 41 41 A Y E +AD 8 67A 27 -33,-1.3 -33,-1.4 -2,-0.6 2,-0.3 -0.956 2.2 172.0-119.5 145.0 9.9 32.4 84.4 42 42 A A E -AD 7 66A 1 24,-2.2 24,-2.6 -2,-0.4 2,-0.4 -0.963 22.3-164.4-159.0 134.2 8.1 33.6 81.3 43 43 A E E -AD 6 65A 22 -37,-2.2 -37,-1.5 -2,-0.3 2,-0.6 -0.971 11.2-164.3-116.4 129.9 7.1 36.9 79.6 44 44 A L E -AD 5 64A 19 20,-1.6 20,-1.1 -2,-0.4 2,-0.3 -0.927 7.9-169.5-117.0 106.8 4.5 36.8 76.8 45 45 A K E -A 4 0A 30 -41,-4.0 -41,-1.8 -2,-0.6 2,-0.4 -0.770 9.9-177.1 -97.3 141.5 4.4 39.9 74.7 46 46 A L E +A 3 0A 14 -2,-0.3 -43,-0.2 16,-0.3 2,-0.2 -0.911 22.3 156.1-131.3 99.8 1.6 40.5 72.1 47 47 A G E -A 2 0A 1 -45,-1.6 -45,-3.2 -2,-0.4 2,-0.3 -0.611 18.5-171.6-117.7-172.5 2.1 43.7 70.2 48 48 A Q E -E 60 0A 49 12,-2.5 12,-2.5 -47,-0.2 2,-0.8 -0.820 32.0-118.5-178.4 133.7 1.1 45.2 66.9 49 49 A E E -E 59 0A 97 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.715 34.8-172.9 -75.4 110.4 1.8 48.2 64.7 50 50 A V E + 0 0 43 8,-1.8 2,-0.3 -2,-0.8 9,-0.2 0.604 58.4 14.6 -89.7 -7.7 -1.7 49.6 64.6 51 51 A W E +E 58 0A 38 7,-1.2 7,-2.0 725,-0.0 2,-0.4 -0.917 57.3 176.2-165.8 135.6 -1.3 52.5 62.1 52 52 A K E +E 57 0A 107 -2,-0.3 2,-0.3 5,-0.3 5,-0.3 -0.988 6.6 175.4-146.0 129.7 1.2 53.5 59.5 53 53 A E E > -E 56 0A 124 3,-3.5 3,-1.7 -2,-0.4 2,-0.7 -0.760 68.6 -60.3-135.8 94.6 1.2 56.3 57.0 54 54 A G T 3 S- 0 0 62 -2,-0.3 -1,-0.0 1,-0.3 0, 0.0 -0.648 127.0 -5.7 74.2-117.8 4.3 56.6 55.0 55 55 A D T 3 S+ 0 0 128 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.3 0.659 121.2 87.6 -81.6 -23.5 7.0 57.2 57.6 56 56 A K E < +E 53 0A 58 -3,-1.7 -3,-3.5 34,-0.1 2,-0.3 -0.638 49.1 158.0 -85.4 137.2 4.6 57.5 60.6 57 57 A S E -EF 52 89A 16 32,-1.1 32,-1.7 -2,-0.3 2,-0.4 -0.955 32.7-140.4-151.5 162.0 3.3 54.6 62.7 58 58 A F E -EF 51 88A 0 -7,-2.0 -8,-1.8 -2,-0.3 -7,-1.2 -0.998 21.8-164.0-123.7 120.1 1.8 53.8 66.1 59 59 A Y E -EF 49 87A 50 28,-2.4 28,-2.5 -2,-0.4 2,-0.5 -0.921 3.9-156.2-106.9 136.5 3.0 50.6 67.7 60 60 A F E -EF 48 86A 0 -12,-2.5 -12,-2.5 -2,-0.4 2,-0.3 -0.971 15.3-178.3-116.8 121.9 1.1 49.0 70.6 61 61 A D E + F 0 85A 20 24,-2.0 24,-1.8 -2,-0.5 2,-0.3 -0.920 4.8 177.2-120.7 141.7 3.1 46.7 73.0 62 62 A T E - F 0 84A 2 -2,-0.3 -16,-0.3 22,-0.2 2,-0.3 -0.912 7.8-166.1-136.2 166.3 2.1 44.6 76.0 63 63 A N E - F 0 83A 0 20,-1.9 19,-1.5 -2,-0.3 20,-1.3 -0.884 6.0-176.1-158.8 125.6 3.8 42.2 78.5 64 64 A V E -DF 44 81A 8 -20,-1.1 -20,-1.6 -2,-0.3 2,-0.3 -0.979 17.9-157.2-126.3 114.4 2.4 39.7 81.0 65 65 A A E -DF 43 80A 0 15,-2.0 15,-2.1 -2,-0.5 2,-0.4 -0.734 9.3-173.1-100.5 142.4 4.9 37.8 83.2 66 66 A Y E -D 42 0A 9 -24,-2.6 -24,-2.2 -2,-0.3 2,-0.4 -0.949 5.8-177.3-126.7 154.2 4.6 34.5 85.0 67 67 A S E +D 41 0A 50 -2,-0.4 2,-0.2 -26,-0.2 -26,-0.2 -0.886 10.5 171.1-156.8 103.6 6.9 32.9 87.4 68 68 A V E -D 40 0A 10 -28,-2.3 -28,-2.2 -2,-0.4 9,-0.1 -0.720 39.0-120.6-111.6 172.3 6.0 29.5 88.8 69 69 A A - 0 0 57 -2,-0.2 -28,-0.1 -30,-0.2 -1,-0.0 0.553 35.3-135.6 -90.0 -12.7 8.1 27.1 90.9 70 70 A Q + 0 0 11 2,-0.2 3,-0.1 -30,-0.1 -60,-0.0 0.893 69.7 117.3 57.6 51.6 8.0 24.2 88.5 71 71 A Q S S+ 0 0 21 1,-0.2 2,-0.3 920,-0.1 -1,-0.1 0.346 80.2 16.8-121.4 -0.1 7.4 21.5 91.0 72 72 A N S S- 0 0 47 918,-0.2 -1,-0.2 1,-0.2 -2,-0.2 -0.967 71.9-114.3-157.5 175.0 4.0 20.6 89.5 73 73 A D S S+ 0 0 21 894,-0.3 2,-1.0 -2,-0.3 -1,-0.2 0.974 102.9 52.2 -77.4 -74.6 1.8 20.9 86.5 74 74 A W + 0 0 113 850,-0.1 2,-0.5 1,-0.1 -1,-0.2 -0.515 68.8 163.5 -69.0 102.5 -1.1 23.0 87.8 75 75 A E - 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