==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN, TRANSPORT PROTEIN 28-NOV-11 3UU6 . COMPND 2 MOLECULE: GLR4197 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOEOBACTER VIOLACEUS; . AUTHOR L.SAUGUET,H.NURY,P.J.CORRINGER,M.DELARUE . 1555 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 63121.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1180 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 375 24.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 1.0 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 . 145 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 460 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.3 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 10 0 0 0 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 5 0 5 RESIDUES PER ALPHA HELIX . 0 5 0 0 5 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 . 10 5 5 0 0 0 0 5 0 5 5 5 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 5 0 0 5 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 5 A V 0 0 138 0, 0.0 66,-0.1 0, 0.0 65,-0.0 0.000 360.0 360.0 360.0 147.3 27.1 -7.9 -8.6 2 6 A S - 0 0 66 1,-0.1 66,-0.1 66,-0.1 0, 0.0 -0.782 360.0 -77.5-127.3 167.8 28.5 -4.3 -8.2 3 7 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 42,-0.0 -0.356 57.3 -88.5 -68.9 155.0 27.7 -1.6 -5.5 4 8 A P - 0 0 2 0, 0.0 8,-0.1 0, 0.0 40,-0.0 -0.326 51.1-114.1 -59.1 136.4 24.5 0.5 -5.6 5 9 A P - 0 0 75 0, 0.0 2,-0.3 0, 0.0 41,-0.2 -0.472 28.1-106.8 -76.8 147.5 25.1 3.7 -7.7 6 10 A P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 6,-0.0 -0.566 15.9-155.4 -75.9 133.0 25.1 7.2 -6.1 7 11 A I S S+ 0 0 120 -2,-0.3 2,-0.2 3,-0.0 0, 0.0 0.995 92.4 2.6 -63.3 -59.7 22.0 9.3 -6.9 8 12 A A S S- 0 0 61 -3,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.408 114.3 -75.0-104.3-172.1 24.1 12.5 -6.2 9 13 A D S S+ 0 0 162 -2,-0.2 -2,-0.0 -3,-0.1 0, 0.0 0.349 84.9 140.1 -75.6 5.5 27.8 12.0 -5.4 10 14 A E - 0 0 54 1,-0.1 2,-0.1 124,-0.1 125,-0.1 0.053 53.8-113.2 -53.0 147.2 27.1 10.7 -1.7 11 15 A P - 0 0 64 0, 0.0 2,-0.5 0, 0.0 125,-0.2 -0.496 38.6 -99.4 -80.3 155.8 28.9 7.9 0.1 12 16 A L E -a 136 0A 8 123,-3.5 125,-3.5 -2,-0.1 2,-0.6 -0.649 32.7-145.4 -79.3 124.7 27.0 4.7 0.9 13 17 A T E -a 137 0A 61 -2,-0.5 2,-0.6 123,-0.2 31,-0.3 -0.821 11.6-167.7 -93.1 115.7 25.8 4.6 4.5 14 18 A V E -a 138 0A 0 123,-3.0 125,-2.4 -2,-0.6 2,-0.4 -0.930 13.1-147.7-103.6 114.4 25.8 1.1 6.0 15 19 A N E -aB 139 42A 57 27,-3.6 27,-2.0 -2,-0.6 2,-0.3 -0.752 21.3-165.5 -85.0 129.6 23.9 1.0 9.3 16 20 A T E +aB 140 41A 0 123,-3.2 125,-2.7 -2,-0.4 2,-0.3 -0.847 17.4 174.8-119.8 158.8 25.4 -1.5 11.8 17 21 A G E - B 0 40A 0 23,-1.3 23,-2.9 -2,-0.3 2,-0.4 -0.951 12.6-159.4-160.6 138.2 24.4 -3.2 15.0 18 22 A I E - B 0 39A 0 -2,-0.3 128,-1.8 21,-0.2 2,-0.5 -0.997 5.8-169.6-123.1 125.9 25.9 -5.9 17.2 19 23 A Y E -cB 146 38A 43 19,-2.1 19,-2.2 -2,-0.4 128,-0.3 -0.939 20.6-136.2-118.3 105.2 23.7 -7.8 19.7 20 24 A L E +cB 147 37A 0 126,-2.2 128,-2.5 -2,-0.5 17,-0.3 -0.435 30.5 167.9 -64.7 124.8 25.7 -10.0 22.2 21 25 A I E S+ 0 0 11 15,-2.6 2,-0.3 1,-0.4 16,-0.2 0.804 72.2 11.0 -96.7 -46.6 24.2 -13.5 22.7 22 26 A E E - B 0 36A 11 14,-2.7 14,-3.0 129,-0.1 2,-0.4 -0.998 55.4-170.4-141.9 144.8 27.4 -14.9 24.5 23 27 A S E + B 0 35A 0 129,-0.5 129,-0.4 -2,-0.3 2,-0.3 -0.983 30.4 139.2-130.2 128.1 30.6 -13.5 26.1 24 28 A Y E + B 0 34A 10 10,-2.4 10,-3.1 -2,-0.4 129,-0.1 -0.972 33.9 46.5-162.3 174.6 33.3 -16.0 27.2 25 29 A S E - 0 0 51 -2,-0.3 2,-1.1 8,-0.2 -1,-0.1 0.866 50.0-174.5 52.6 53.6 37.0 -16.9 27.5 26 30 A L E - 0 0 27 7,-0.2 2,-0.8 128,-0.2 7,-0.3 -0.685 9.7-163.7 -78.2 103.1 38.5 -13.6 28.7 27 31 A D E >> - B 0 32A 68 5,-2.7 5,-1.6 -2,-1.1 4,-1.3 -0.835 10.4-168.4 -90.3 108.3 42.2 -14.6 28.6 28 32 A D T 45S+ 0 0 19 -2,-0.8 -1,-0.2 2,-0.2 82,-0.2 0.918 87.3 46.5 -62.9 -46.2 44.3 -12.1 30.7 29 33 A C T 45S+ 0 0 61 1,-0.2 -1,-0.2 212,-0.2 215,-0.1 0.915 119.8 39.2 -63.2 -44.4 47.7 -13.3 29.4 30 34 A A T 45S- 0 0 31 2,-0.1 -1,-0.2 1243,-0.0 -2,-0.2 0.612 101.1-135.0 -78.1 -18.5 46.6 -13.3 25.7 31 35 A E T <5 + 0 0 17 -4,-1.3 77,-2.0 1,-0.2 2,-0.3 0.918 64.6 121.5 57.1 46.5 44.5 -10.1 26.2 32 36 A T E < -BD 27 107A 2 -5,-1.6 -5,-2.7 75,-0.2 2,-0.3 -0.918 42.4-171.4-133.8 161.6 41.6 -11.7 24.2 33 37 A F E - D 0 106A 2 73,-1.9 73,-2.9 -2,-0.3 2,-0.3 -0.976 21.4-126.6-150.4 149.2 38.0 -12.7 24.7 34 38 A K E -BD 24 105A 62 -10,-3.1 -10,-2.4 -2,-0.3 2,-0.3 -0.796 25.6-169.7-104.1 146.3 35.5 -14.7 22.6 35 39 A V E -BD 23 104A 0 69,-2.0 69,-2.1 -2,-0.3 2,-0.4 -0.986 17.2-165.0-137.7 143.9 32.1 -13.4 21.5 36 40 A N E +BD 22 103A 7 -14,-3.0 -14,-2.7 -2,-0.3 -15,-2.6 -0.989 36.5 140.8-130.1 115.3 29.0 -14.8 20.0 37 41 A A E -BD 20 102A 0 65,-2.4 65,-3.2 -2,-0.4 2,-0.4 -0.937 51.5 -99.6-149.6 170.3 26.6 -12.1 18.6 38 42 A F E -BD 19 101A 4 -19,-2.2 -19,-2.1 -2,-0.3 2,-0.5 -0.818 29.2-157.1 -94.3 136.0 24.2 -11.0 15.8 39 43 A L E -BD 18 100A 0 61,-3.2 61,-2.6 -2,-0.4 2,-0.4 -0.988 10.2-165.9-114.8 121.4 25.6 -8.6 13.3 40 44 A S E -BD 17 99A 9 -23,-2.9 -23,-1.3 -2,-0.5 2,-0.4 -0.928 4.9-173.4-110.8 132.7 22.9 -6.5 11.5 41 45 A L E -BD 16 98A 5 57,-2.5 57,-3.2 -2,-0.4 2,-0.3 -0.985 3.6-179.9-127.2 138.6 23.6 -4.5 8.4 42 46 A S E +BD 15 97A 16 -27,-2.0 -27,-3.6 -2,-0.4 2,-0.3 -0.977 12.7 146.9-143.4 127.9 21.3 -2.0 6.5 43 47 A W E - D 0 96A 3 53,-1.1 53,-3.0 -2,-0.3 2,-0.5 -0.957 43.9-104.5-151.7 161.0 21.9 0.0 3.4 44 48 A K E + D 0 95A 79 -31,-0.3 2,-0.4 -2,-0.3 51,-0.2 -0.837 29.2 176.0 -97.6 123.4 19.8 1.4 0.4 45 49 A D > - 0 0 3 49,-3.6 3,-2.0 -2,-0.5 4,-0.4 -0.870 9.2-170.0-127.1 93.3 20.1 -0.3 -3.0 46 50 A R G > S+ 0 0 122 -2,-0.4 3,-1.7 1,-0.3 -1,-0.1 0.812 83.5 67.3 -51.8 -37.1 17.7 1.4 -5.4 47 51 A R G 3 S+ 0 0 108 1,-0.3 -1,-0.3 47,-0.1 47,-0.1 0.728 99.8 52.8 -56.1 -25.6 18.2 -1.4 -8.1 48 52 A L G < S+ 0 0 20 -3,-2.0 -1,-0.3 46,-0.2 46,-0.2 0.587 85.3 119.3 -88.3 -12.8 16.5 -3.8 -5.6 49 53 A A < + 0 0 46 -3,-1.7 2,-0.3 -4,-0.4 44,-0.2 -0.023 36.7 169.8 -54.1 151.5 13.3 -1.5 -5.2 50 54 A F - 0 0 31 42,-2.6 44,-0.1 41,-0.1 -2,-0.0 -0.944 36.1-101.7-156.1 170.8 9.8 -2.8 -6.2 51 55 A D > - 0 0 52 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.914 18.3-150.5-104.3 126.7 6.0 -2.0 -5.9 52 56 A P H > S+ 0 0 40 0, 0.0 4,-1.9 0, 0.0 5,-0.4 0.829 96.9 54.9 -65.1 -29.8 4.0 -3.9 -3.3 53 57 A V H 4 S+ 0 0 126 2,-0.2 5,-0.0 3,-0.1 -2,-0.0 0.962 114.0 37.4 -64.1 -58.8 0.8 -3.7 -5.5 54 58 A R H 4 S+ 0 0 221 1,-0.2 -1,-0.1 2,-0.1 -4,-0.0 0.922 123.6 43.1 -59.4 -50.4 2.4 -5.3 -8.6 55 59 A S H < S- 0 0 49 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.748 93.7-141.0 -70.8 -32.4 4.5 -7.9 -6.6 56 60 A G S < S+ 0 0 60 -4,-1.9 2,-0.3 -5,-0.2 -3,-0.1 0.639 73.6 89.5 75.4 14.3 1.8 -8.8 -4.1 57 61 A V - 0 0 73 -5,-0.4 -1,-0.2 -6,-0.2 -2,-0.2 -0.988 63.5-153.9-139.3 137.4 4.4 -8.9 -1.3 58 62 A R S S+ 0 0 193 -2,-0.3 2,-0.3 -3,-0.1 -8,-0.1 0.500 85.2 41.0 -90.5 -3.2 5.6 -6.1 1.0 59 63 A V - 0 0 36 32,-0.2 2,-0.4 -7,-0.1 32,-0.2 -0.988 67.4-150.7-142.7 145.9 9.0 -7.7 1.6 60 64 A K E -E 90 0A 62 30,-2.1 30,-2.8 -2,-0.3 2,-0.5 -0.979 9.4-154.8-120.6 130.6 11.6 -9.5 -0.7 61 65 A T E -E 89 0A 89 -2,-0.4 2,-0.2 28,-0.2 28,-0.2 -0.932 16.8-178.0-110.1 118.6 13.9 -12.3 0.7 62 66 A Y - 0 0 68 26,-0.9 26,-0.3 -2,-0.5 3,-0.0 -0.654 27.3-118.9-109.0 165.9 17.3 -12.9 -1.2 63 67 A E >> - 0 0 129 -2,-0.2 3,-1.2 24,-0.1 4,-0.9 -0.755 37.3-109.6 -96.7 144.3 20.2 -15.4 -0.8 64 68 A P G >4 S+ 0 0 42 0, 0.0 3,-0.7 0, 0.0 5,-0.1 0.846 118.4 52.8 -44.3 -44.6 23.6 -13.7 -0.1 65 69 A E G 34 S+ 0 0 155 1,-0.2 4,-0.1 3,-0.1 -3,-0.0 0.809 100.9 63.2 -60.4 -37.0 25.0 -14.6 -3.6 66 70 A A G <4 S+ 0 0 56 -3,-1.2 -1,-0.2 2,-0.1 2,-0.2 0.780 107.6 34.6 -61.2 -37.9 21.9 -13.0 -5.3 67 71 A I S << S- 0 0 7 -4,-0.9 2,-0.5 -3,-0.7 0, 0.0 -0.685 89.3 -92.2-119.7 172.8 22.6 -9.4 -4.1 68 72 A W - 0 0 27 -2,-0.2 -3,-0.1 -66,-0.1 -66,-0.1 -0.759 41.5-175.0 -84.4 122.3 25.4 -7.0 -3.4 69 73 A I - 0 0 38 -2,-0.5 2,-0.0 -5,-0.1 0, 0.0 -0.975 29.3-112.4-119.3 129.2 26.4 -7.2 0.3 70 74 A P - 0 0 5 0, 0.0 2,-1.3 0, 0.0 -27,-0.0 -0.373 28.6-118.4 -62.1 137.9 29.0 -4.7 1.8 71 75 A E - 0 0 105 58,-0.2 58,-0.6 1263,-0.1 2,-0.5 -0.672 40.5-179.1 -79.0 92.2 32.2 -6.5 2.9 72 76 A I E +H 128 0B 7 -2,-1.3 2,-0.3 56,-0.1 56,-0.2 -0.841 2.7 177.6 -95.9 129.7 32.3 -5.7 6.6 73 77 A R E -H 127 0B 34 54,-2.4 54,-2.8 -2,-0.5 2,-0.4 -0.853 29.6-117.8-127.0 162.9 35.2 -7.0 8.6 74 78 A F E -H 126 0B 4 -2,-0.3 3,-0.4 52,-0.2 52,-0.2 -0.854 15.5-155.0 -99.9 136.7 36.4 -6.8 12.2 75 79 A V S S+ 0 0 15 50,-2.8 2,-0.8 -2,-0.4 -1,-0.2 0.994 87.3 43.5 -71.5 -63.7 39.7 -5.0 12.7 76 80 A N S S+ 0 0 5 49,-0.1 31,-3.3 30,-0.0 2,-0.3 -0.169 81.7 122.6 -81.5 38.2 40.8 -6.7 16.0 77 81 A V B -F 106 0A 4 -2,-0.8 29,-0.2 -3,-0.4 3,-0.1 -0.753 57.1-141.9 -98.4 150.0 39.9 -10.3 15.4 78 82 A E S S+ 0 0 8 27,-2.6 2,-0.3 -2,-0.3 -1,-0.2 0.993 91.1 5.2 -69.1 -61.5 42.5 -13.2 15.7 79 83 A N S S- 0 0 72 26,-0.2 26,-0.4 1,-0.1 -1,-0.2 -0.807 104.4 -77.6-116.9 158.6 41.0 -15.1 12.7 80 84 A A - 0 0 61 -2,-0.3 -1,-0.1 1,-0.1 -7,-0.0 -0.318 64.9 -91.9 -56.7 134.4 38.2 -13.9 10.4 81 85 A R - 0 0 53 1,-0.1 2,-0.8 -7,-0.1 23,-0.2 -0.020 28.0-120.8 -50.6 147.9 34.8 -14.4 12.2 82 86 A D E - G 0 103A 94 21,-2.4 21,-1.5 -3,-0.1 2,-0.4 -0.882 45.5-177.9 -91.6 109.3 32.7 -17.6 11.8 83 87 A A E - G 0 102A 41 -2,-0.8 2,-0.4 19,-0.2 19,-0.2 -0.925 24.5-172.1-121.5 145.5 29.5 -16.2 10.3 84 88 A D E - G 0 101A 101 17,-2.1 17,-2.8 -2,-0.4 2,-0.3 -0.992 29.4-125.3-132.3 118.9 26.1 -17.7 9.3 85 89 A V E - G 0 100A 51 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.533 25.5-178.2 -68.2 124.5 23.5 -15.5 7.4 86 90 A V E - 0 0 11 13,-3.2 2,-0.3 1,-0.3 14,-0.2 0.855 62.8 -18.9 -88.9 -47.4 20.2 -15.6 9.4 87 91 A D E - G 0 99A 21 12,-1.8 12,-2.5 2,-0.0 2,-0.4 -0.970 41.8-157.8-166.0 148.2 18.2 -13.4 7.0 88 92 A I E - G 0 98A 2 -26,-0.3 -26,-0.9 -2,-0.3 2,-0.4 -0.982 24.3-176.9-131.7 114.1 18.3 -10.8 4.1 89 93 A S E -EG 61 97A 6 8,-2.3 8,-2.8 -2,-0.4 2,-0.5 -0.953 11.6-157.1-121.0 134.6 15.1 -8.7 3.7 90 94 A V E -EG 60 96A 0 -30,-2.8 -30,-2.1 -2,-0.4 6,-0.2 -0.950 6.8-150.9-114.9 127.0 14.3 -6.0 1.1 91 95 A S > - 0 0 28 4,-2.1 3,-1.9 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