==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 01-SEP-10 2XQ4 . COMPND 2 MOLECULE: GLR4197 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOEOBACTER VIOLACEUS PCC 7421; . AUTHOR R.J.C.HILF,C.BERTOZZI,I.ZIMMERMANN,A.REITER,D.TRAUNER,R.DUTZ . 1550 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 64558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1155 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 305 19.7 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 . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 5 0.3 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 . 182 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 174 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 381 24.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 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 3 0 0 0 0 5 0 10 0 0 0 0 0 0 0 0 0 0 0 4 1 0 0 0 0 0 5 RESIDUES PER ALPHA HELIX . 0 0 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 . 15 5 0 5 0 15 5 0 0 0 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 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 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 7 A P 0 0 120 0, 0.0 64,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 72.7 28.9 -15.9 95.4 2 8 A P - 0 0 41 0, 0.0 2,-0.6 0, 0.0 64,-0.0 -0.138 360.0 -87.4 -75.5 163.8 25.4 -17.5 94.7 3 9 A P - 0 0 6 0, 0.0 2,-0.6 0, 0.0 6,-0.1 -0.591 36.5-124.7 -80.7 113.4 22.5 -17.6 97.2 4 10 A I + 0 0 128 -2,-0.6 39,-0.1 -3,-0.1 2,-0.1 -0.389 45.8 175.5 -57.4 101.3 22.5 -20.6 99.5 5 11 A A - 0 0 32 -2,-0.6 -1,-0.0 1,-0.1 37,-0.0 -0.271 40.8-138.2 -99.4-175.8 19.1 -22.1 98.8 6 12 A D S S- 0 0 134 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 0.445 87.5 -1.3-118.2 -15.3 17.2 -25.2 99.9 7 13 A E S S- 0 0 148 124,-0.1 2,-0.3 3,-0.0 -1,-0.2 -0.846 112.3 -31.5-152.1-172.6 15.8 -26.0 96.4 8 14 A P - 0 0 51 0, 0.0 2,-0.4 0, 0.0 124,-0.2 -0.374 65.6-129.0 -53.4 112.5 15.8 -24.6 92.9 9 15 A L E -a 132 0A 14 122,-1.4 124,-1.8 -2,-0.3 2,-0.4 -0.522 18.1-139.0 -65.1 121.2 16.0 -20.8 93.2 10 16 A T E -a 133 0A 58 -2,-0.4 2,-0.5 122,-0.2 31,-0.4 -0.702 11.9-158.8 -83.5 127.9 13.2 -19.1 91.3 11 17 A V E -a 134 0A 0 122,-2.5 124,-1.9 -2,-0.4 2,-0.6 -0.939 13.3-139.4-106.1 130.0 14.2 -16.0 89.4 12 18 A N E -a 135 0A 45 27,-3.5 124,-0.2 -2,-0.5 2,-0.1 -0.797 23.3-167.5 -99.7 116.7 11.3 -13.6 88.5 13 19 A T E +a 136 0A 0 122,-3.3 124,-3.4 -2,-0.6 127,-0.3 -0.379 14.9 165.1-103.4 172.7 11.4 -12.0 85.1 14 20 A G - 0 0 0 23,-0.2 23,-2.9 122,-0.2 2,-0.5 -0.818 17.5-152.2 178.0 137.4 9.6 -9.2 83.1 15 21 A I E -B 36 0B 0 -2,-0.2 2,-0.9 21,-0.2 128,-0.4 -0.950 2.3-168.4-129.2 118.1 10.0 -7.1 80.0 16 22 A Y E -B 35 0B 30 19,-1.2 19,-1.5 -2,-0.5 128,-0.2 -0.808 20.9-144.6-101.6 93.5 8.6 -3.6 79.4 17 23 A L E +B 34 0B 2 -2,-0.9 128,-0.7 126,-0.3 17,-0.3 -0.364 26.0 171.2 -52.2 122.6 9.0 -2.9 75.7 18 24 A I E + 0 0 5 15,-2.7 2,-0.4 1,-0.4 16,-0.2 0.779 65.5 13.6-102.2 -43.5 9.9 0.8 75.5 19 25 A E E -B 33 0B 16 14,-2.6 14,-2.4 129,-0.1 -1,-0.4 -0.997 57.0-172.5-140.0 137.3 10.7 0.9 71.8 20 26 A C E +B 32 0B 0 -2,-0.4 130,-1.5 12,-0.2 129,-0.3 -0.961 28.2 127.0-122.2 148.9 10.2 -1.3 68.7 21 27 A Y E +B 31 0B 5 10,-1.8 10,-2.0 -2,-0.3 3,-0.1 -0.980 36.6 53.4-176.7-179.3 11.7 -0.6 65.3 22 28 A S E - 0 0 29 316,-0.4 2,-0.6 -2,-0.3 -1,-0.1 0.811 52.7-177.8 33.4 54.3 13.7 -1.7 62.2 23 29 A L E - 0 0 22 7,-0.2 2,-0.8 128,-0.2 7,-0.3 -0.730 12.7-158.1 -71.2 119.3 11.8 -5.0 61.6 24 30 A D E >> -B 29 0B 68 5,-2.5 4,-2.5 -2,-0.6 5,-1.1 -0.815 16.6-171.7-115.6 93.4 13.9 -6.3 58.7 25 31 A D T 45S+ 0 0 29 -2,-0.8 -1,-0.2 1,-0.2 82,-0.1 0.837 87.7 50.1 -51.5 -44.9 12.0 -8.8 56.5 26 32 A K T 45S+ 0 0 108 1,-0.2 -1,-0.2 213,-0.1 215,-0.1 0.966 120.2 35.1 -56.1 -53.6 15.0 -9.7 54.4 27 33 A A T 45S- 0 0 32 2,-0.1 -2,-0.2 213,-0.1 -1,-0.2 0.653 101.2-133.2 -79.1 -19.4 17.2 -10.3 57.5 28 34 A E T <5 + 0 0 15 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.916 68.0 106.8 63.4 47.7 14.4 -11.7 59.6 29 35 A T E < -B 24 0B 3 -5,-1.1 -5,-2.5 75,-0.2 2,-0.3 -0.814 46.0-168.3-139.3 177.7 15.3 -9.6 62.6 30 36 A F E - C 0 103B 2 73,-1.6 73,-3.2 -2,-0.3 2,-0.4 -0.957 21.6-119.1-167.0 157.0 14.1 -6.6 64.5 31 37 A K E -BC 21 102B 53 -10,-2.0 -10,-1.8 -2,-0.3 2,-0.3 -0.859 27.3-177.2-107.8 139.8 15.4 -4.3 67.1 32 38 A V E -BC 20 101B 0 69,-1.4 69,-1.2 -2,-0.4 2,-0.4 -0.942 15.0-162.0-129.9 157.1 13.8 -3.8 70.5 33 39 A N E +BC 19 100B 4 -14,-2.4 -15,-2.7 -2,-0.3 -14,-2.6 -0.930 34.9 143.2-140.6 108.4 14.5 -1.5 73.5 34 40 A A E -B 17 0B 0 65,-1.6 2,-0.3 -2,-0.4 -17,-0.3 -0.771 48.6 -93.5-140.0 177.6 13.0 -2.6 76.7 35 41 A F E -B 16 0B 1 -19,-1.5 -19,-1.2 -2,-0.2 2,-0.5 -0.784 28.2-152.4 -93.8 143.8 13.1 -3.0 80.5 36 42 A L E -BD 15 97B 0 61,-2.8 61,-2.4 -2,-0.3 2,-0.6 -0.978 11.0-167.3-119.5 119.4 14.3 -6.2 82.1 37 43 A S E + D 0 96B 5 -23,-2.9 2,-0.3 -2,-0.5 59,-0.2 -0.914 11.5 171.2-112.4 117.6 12.9 -6.9 85.5 38 44 A L E + D 0 95B 3 57,-1.6 57,-2.4 -2,-0.6 2,-0.3 -0.844 3.0 172.3-121.0 158.9 14.4 -9.7 87.6 39 45 A S E + D 0 94B 21 -2,-0.3 -27,-3.5 55,-0.2 2,-0.3 -0.947 3.9 158.2-165.1 148.6 14.0 -10.8 91.3 40 46 A W E - D 0 93B 4 53,-0.8 53,-2.6 -2,-0.3 2,-0.8 -0.985 42.2 -98.8-164.4 156.3 15.0 -13.6 93.7 41 47 A K E + D 0 92B 116 -31,-0.4 2,-0.5 -2,-0.3 51,-0.3 -0.765 32.5 172.1 -89.1 111.9 15.3 -14.4 97.4 42 48 A D > + 0 0 0 49,-3.5 3,-2.9 -2,-0.8 -1,-0.1 -0.661 4.7 179.6-110.4 68.8 18.9 -14.1 98.6 43 49 A R G > + 0 0 115 -2,-0.5 3,-2.1 1,-0.3 -1,-0.1 0.738 69.2 84.6 -40.6 -27.3 18.1 -14.6 102.3 44 50 A R G 3 S+ 0 0 104 1,-0.3 -1,-0.3 47,-0.1 47,-0.1 0.609 95.5 38.8 -55.6 -19.5 21.9 -14.2 102.7 45 51 A L G < S+ 0 0 25 -3,-2.9 -1,-0.3 46,-0.2 46,-0.3 -0.192 76.9 141.0-131.3 43.4 21.4 -10.4 102.7 46 52 A A < - 0 0 50 -3,-2.1 44,-0.2 44,-0.3 42,-0.0 -0.487 37.1-156.1 -69.2 155.1 18.3 -9.9 104.7 47 53 A F - 0 0 28 42,-1.0 5,-0.2 -2,-0.2 43,-0.1 -0.024 23.1-109.9-154.7 49.0 18.7 -6.9 106.9 48 54 A D > - 0 0 83 41,-0.1 4,-1.4 3,-0.1 42,-0.0 0.807 29.4-152.4 41.6 76.0 17.0 -6.0 110.1 49 55 A P T >4 S+ 0 0 67 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.919 91.3 35.3 -45.1 -59.4 14.9 -3.0 109.0 50 56 A V T 34 S+ 0 0 136 1,-0.2 -2,-0.1 5,-0.0 5,-0.0 0.959 109.4 62.9 -62.1 -54.8 14.8 -1.3 112.4 51 57 A R T 34 S- 0 0 210 3,-0.0 2,-0.3 1,-0.0 -1,-0.2 0.690 118.6 -2.3 -46.8 -29.6 18.3 -2.2 113.6 52 58 A S S << S- 0 0 65 -4,-1.4 -5,-0.0 -3,-0.5 -1,-0.0 -0.971 106.2 -12.1-156.3 169.4 19.9 -0.2 110.7 53 59 A G S S- 0 0 70 -2,-0.3 2,-0.1 2,-0.0 4,-0.1 0.142 82.1 -68.8 38.5-135.8 19.4 1.9 107.6 54 60 A V - 0 0 102 2,-0.1 -2,-0.1 -3,-0.0 3,-0.1 -0.405 60.8 -52.7-135.5-156.3 15.9 2.0 106.1 55 61 A R S S+ 0 0 215 1,-0.2 2,-0.3 -2,-0.1 -5,-0.0 0.891 116.5 6.9 -60.3 -48.2 13.1 0.3 104.2 56 62 A V S S- 0 0 44 32,-0.1 2,-0.5 33,-0.0 -1,-0.2 -0.996 71.6-136.4-141.7 143.6 15.2 -1.0 101.3 57 63 A K E -E 87 0B 104 30,-1.6 30,-1.7 -2,-0.3 2,-0.3 -0.898 15.0-137.5-112.8 120.9 18.9 -0.9 100.6 58 64 A T E -E 86 0B 43 -2,-0.5 2,-0.3 28,-0.2 28,-0.2 -0.530 23.0-173.0 -78.0 128.9 20.5 0.0 97.3 59 65 A Y - 0 0 62 26,-1.1 26,-0.2 -2,-0.3 -1,-0.0 -0.860 24.0-126.9-117.8 155.3 23.4 -2.0 95.9 60 66 A E >> - 0 0 114 -2,-0.3 3,-1.7 1,-0.1 4,-1.0 -0.758 38.0-109.6 -91.3 147.9 25.8 -1.7 93.0 61 67 A P T 34 S+ 0 0 33 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.759 116.0 62.9 -48.3 -35.1 25.9 -5.0 90.8 62 68 A E T 34 S+ 0 0 159 1,-0.2 4,-0.1 3,-0.1 -3,-0.0 0.842 101.6 52.8 -62.5 -33.8 29.5 -5.7 92.0 63 69 A A T <4 S+ 0 0 66 -3,-1.7 -1,-0.2 2,-0.1 2,-0.1 0.927 106.0 52.1 -69.4 -48.9 28.2 -6.1 95.6 64 70 A I S < S- 0 0 15 -4,-1.0 2,-0.6 1,-0.1 0, 0.0 -0.477 86.9-109.7 -90.7 156.6 25.4 -8.6 95.1 65 71 A W - 0 0 37 -64,-0.2 -3,-0.1 -2,-0.1 -2,-0.1 -0.795 42.3-169.9 -78.6 120.8 25.3 -12.0 93.4 66 72 A I - 0 0 40 -2,-0.6 2,-0.3 -5,-0.1 0, 0.0 -0.925 21.8-117.1-116.7 142.6 23.3 -11.5 90.2 67 73 A P - 0 0 12 0, 0.0 2,-0.8 0, 0.0 -2,-0.0 -0.585 26.6-122.0 -77.0 132.2 22.0 -14.2 87.8 68 74 A E - 0 0 123 -2,-0.3 2,-0.7 58,-0.2 58,-0.4 -0.641 30.3-173.0 -74.6 110.1 23.3 -14.1 84.3 69 75 A I - 0 0 9 -2,-0.8 2,-0.2 56,-0.1 56,-0.2 -0.837 6.3-173.6-107.8 93.4 20.2 -13.8 82.1 70 76 A R B -H 124 0C 23 -2,-0.7 54,-2.4 54,-0.6 2,-0.4 -0.569 23.6-125.8 -87.0 146.9 21.3 -14.2 78.5 71 77 A F - 0 0 1 52,-0.3 3,-0.4 -2,-0.2 7,-0.1 -0.813 18.7-151.5 -89.1 136.4 18.9 -13.6 75.6 72 78 A V S S+ 0 0 17 -2,-0.4 2,-1.7 1,-0.2 -1,-0.1 0.987 82.6 43.3 -78.7 -62.6 18.9 -16.6 73.2 73 79 A N S S+ 0 0 7 1190,-0.0 31,-2.3 30,-0.0 2,-0.4 -0.523 84.3 127.7 -84.6 70.2 18.1 -15.4 69.8 74 80 A V B -F 103 0B 2 -2,-1.7 29,-0.2 -3,-0.4 4,-0.1 -0.992 56.5-140.7-129.5 137.4 20.2 -12.3 69.7 75 81 A E S S- 0 0 17 27,-1.6 -1,-0.2 -2,-0.4 2,-0.1 0.983 84.0 -3.9 -52.8 -74.7 22.8 -11.2 67.1 76 82 A N S S- 0 0 87 26,-0.2 2,-0.2 1,-0.2 3,-0.1 -0.341 107.7 -49.0-105.4-170.6 25.4 -9.8 69.5 77 83 A A - 0 0 42 1246,-0.1 -1,-0.2 -2,-0.1 -2,-0.1 -0.464 68.7-104.9 -60.1 125.2 25.6 -9.3 73.2 78 84 A R - 0 0 48 -2,-0.2 2,-0.7 -7,-0.1 23,-0.2 -0.127 31.9-127.2 -40.2 148.0 22.5 -7.6 74.4 79 85 A D + 0 0 67 21,-1.0 2,-0.4 -3,-0.1 21,-0.3 -0.698 41.1 167.9-117.7 84.3 23.3 -3.9 75.2 80 86 A A - 0 0 35 -2,-0.7 2,-0.4 19,-0.2 19,-0.2 -0.792 28.2-165.6-114.4 135.6 22.1 -3.1 78.7 81 87 A D E - G 0 98B 84 17,-0.6 17,-2.6 -2,-0.4 2,-0.4 -0.929 34.5-118.8-106.3 136.1 22.6 -0.3 81.3 82 88 A V E - G 0 97B 49 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.643 26.5-173.2 -81.2 130.0 21.5 -1.2 84.9 83 89 A V E - 0 0 10 13,-2.9 2,-0.3 -2,-0.4 14,-0.2 0.842 57.0 -23.8 -96.2 -36.7 18.7 1.0 86.2 84 90 A D E - G 0 96B 22 12,-1.6 12,-1.5 355,-0.0 2,-0.4 -0.927 41.0-156.2-172.6 147.0 18.3 0.0 89.9 85 91 A I E + G 0 95B 3 -2,-0.3 -26,-1.1 -26,-0.2 2,-0.4 -0.979 17.3 177.4-131.6 123.3 18.9 -2.7 92.5 86 92 A S E -EG 58 94B 6 8,-2.1 8,-0.6 -2,-0.4 2,-0.4 -0.862 13.3-157.6-133.8 98.5 16.8 -2.8 95.6 87 93 A V E -EG 57 93B 0 -30,-1.7 -30,-1.6 -2,-0.4 6,-0.3 -0.609 15.3-143.9 -78.0 126.4 17.1 -5.6 98.2 88 94 A S > - 0 0 35 4,-4.9 3,-1.1 -2,-0.4 -32,-0.1 -0.318 27.1 -99.5 -79.7 165.8 14.1 -6.1 100.4 89 95 A P T 3 S+ 0 0 45 0, 0.0 -42,-1.0 0, 0.0 -41,-0.1 0.958 118.9 54.8 -46.0 -65.4 14.2 -7.1 104.2 90 96 A D T 3 S- 0 0 97 -44,-0.2 -44,-0.3 1,-0.2 -45,-0.1 0.620 130.4 -91.5 -51.9 -14.3 13.6 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