==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 19-JUN-10 3NKG . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN GEBA250068378; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFUROSPIRILLUM DELEYIANUM; . AUTHOR Y.KIM,N.MARSHALL,G.COBB,J.EISEN,C.KERFELD,A.JOACHIMIAK,MIDWE . 340 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 248 72.9 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 . 115 33.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 50 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 0 0 0 2 0 2 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 . 0 2 0 1 1 0 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 4 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 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 0 A A 0 0 100 0, 0.0 168,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 49.1 12.3 17.1 -15.7 2 1 A P - 0 0 36 0, 0.0 165,-0.3 0, 0.0 22,-0.0 -0.292 360.0-108.0 -62.6 147.1 14.9 19.4 -14.1 3 2 A N - 0 0 145 1,-0.1 0, 0.0 163,-0.1 0, 0.0 -0.522 35.2-107.6 -75.5 141.9 16.3 18.5 -10.6 4 3 A P - 0 0 82 0, 0.0 2,-0.4 0, 0.0 162,-0.2 -0.249 26.8-137.9 -63.2 155.9 15.2 20.5 -7.6 5 4 A I E -A 165 0A 56 160,-2.4 160,-2.7 2,-0.0 2,-0.4 -0.976 16.5-163.7-117.9 130.3 17.7 22.9 -5.9 6 5 A S E -A 164 0A 53 -2,-0.4 158,-0.2 158,-0.2 156,-0.0 -0.957 7.6-169.8-120.5 136.6 17.9 23.1 -2.1 7 6 A I E -A 163 0A 0 156,-3.5 156,-3.4 -2,-0.4 2,-0.1 -0.971 23.9-130.5-124.5 113.5 19.6 25.8 -0.0 8 7 A P E -A 162 0A 75 0, 0.0 2,-0.3 0, 0.0 154,-0.2 -0.446 31.6-176.2 -64.8 133.3 20.0 25.2 3.7 9 8 A I E -A 161 0A 15 152,-2.7 152,-0.7 -2,-0.1 2,-0.6 -0.919 24.6-130.9-130.3 162.8 18.8 28.1 5.8 10 9 A D > + 0 0 66 -2,-0.3 3,-0.8 1,-0.1 6,-0.2 -0.896 20.1 176.1-116.6 101.5 18.7 28.9 9.5 11 10 A L T 3 S+ 0 0 2 -2,-0.6 142,-1.7 148,-0.3 145,-0.2 0.451 72.3 75.2 -84.7 -0.3 15.4 30.0 10.9 12 11 A S T 3 S+ 0 0 16 144,-0.3 2,-0.5 140,-0.2 -1,-0.2 0.641 90.2 63.4 -84.8 -13.9 16.7 30.2 14.5 13 12 A Q S X S- 0 0 97 -3,-0.8 3,-1.5 139,-0.1 136,-0.2 -0.946 81.2-127.8-118.8 124.3 18.6 33.5 13.9 14 13 A A T 3 S+ 0 0 63 -2,-0.5 136,-0.2 1,-0.2 137,-0.2 -0.349 95.7 16.5 -59.7 138.2 17.1 36.9 12.9 15 14 A G T 3 S+ 0 0 36 134,-1.8 2,-0.3 1,-0.2 -1,-0.2 0.581 81.5 160.3 74.3 9.7 18.8 38.4 9.8 16 15 A S E < -D 149 0B 23 -3,-1.5 133,-2.8 133,-0.7 2,-0.4 -0.514 20.5-166.4 -66.2 127.0 20.3 35.1 8.7 17 16 A V E -D 148 0B 59 -2,-0.3 2,-0.4 131,-0.2 131,-0.2 -0.944 16.0-177.4-120.8 137.6 21.2 35.4 5.0 18 17 A V E -D 147 0B 34 129,-2.4 129,-3.1 -2,-0.4 2,-0.4 -0.998 6.2-168.3-129.9 139.4 22.2 32.8 2.4 19 18 A E E +D 146 0B 114 -2,-0.4 2,-0.3 127,-0.2 127,-0.2 -0.987 11.7 167.5-129.1 124.2 23.1 33.6 -1.2 20 19 A K E -D 145 0B 81 125,-2.5 125,-2.8 -2,-0.4 2,-0.3 -0.997 35.1-119.5-137.8 147.6 23.4 31.1 -4.1 21 20 A E E -D 144 0B 113 -2,-0.3 2,-0.4 123,-0.2 123,-0.2 -0.628 34.1-163.2 -77.4 140.6 23.7 31.1 -7.8 22 21 A V E -D 143 0B 2 121,-3.3 121,-2.7 -2,-0.3 2,-0.6 -0.992 10.1-150.5-135.1 129.0 20.9 29.2 -9.4 23 22 A K E -D 142 0B 109 -2,-0.4 2,-0.6 119,-0.2 119,-0.2 -0.894 4.9-158.3-106.1 119.0 20.6 27.8 -12.9 24 23 A I E -D 141 0B 4 117,-2.9 117,-2.4 -2,-0.6 3,-0.1 -0.876 8.9-177.0 -94.2 118.3 17.2 27.5 -14.6 25 24 A E + 0 0 105 -2,-0.6 2,-0.4 115,-0.2 115,-0.1 0.695 67.7 40.2 -86.4 -25.7 17.3 24.9 -17.4 26 25 A E S S- 0 0 70 113,-0.1 2,-0.9 115,-0.1 112,-0.2 -0.993 80.2-122.7-133.0 131.6 13.8 25.3 -18.6 27 26 A S S S+ 0 0 62 -2,-0.4 2,-0.3 112,-0.1 112,-0.2 -0.637 71.2 105.7 -68.5 107.8 11.6 28.4 -19.1 28 27 A W E S-B 138 0A 133 110,-1.9 110,-2.3 -2,-0.9 2,-0.3 -0.890 74.0 -69.7-162.3-169.9 8.7 27.5 -16.8 29 28 A S E -B 137 0A 22 139,-0.3 139,-2.8 108,-0.3 2,-0.4 -0.792 45.1-160.9-100.3 150.0 7.1 28.2 -13.5 30 29 A Y E -BC 136 167A 9 106,-2.4 106,-2.6 -2,-0.3 2,-0.3 -0.992 14.3-130.7-134.8 135.6 8.8 27.1 -10.3 31 30 A H E -BC 135 166A 22 135,-2.8 135,-2.2 -2,-0.4 2,-0.5 -0.667 14.5-157.2 -82.3 138.8 7.6 26.5 -6.7 32 31 A L E +BC 134 165A 2 102,-3.2 101,-2.3 -2,-0.3 102,-1.5 -0.977 29.9 155.4-112.4 124.9 9.6 28.1 -3.9 33 32 A I E -BC 132 164A 5 131,-2.3 131,-2.9 -2,-0.5 2,-0.5 -0.912 41.7-121.3-144.0 166.1 9.1 26.3 -0.6 34 33 A L E -BC 131 163A 0 97,-3.0 97,-2.6 -2,-0.3 2,-0.5 -0.969 23.2-159.3-110.8 135.7 10.6 25.5 2.8 35 34 A Q E -BC 130 162A 72 127,-2.7 127,-2.7 -2,-0.5 2,-0.5 -0.966 6.3-153.7-116.6 124.8 11.2 21.9 3.7 36 35 A F E - C 0 161A 12 93,-2.7 125,-0.2 -2,-0.5 2,-0.2 -0.822 11.5-132.4-100.5 127.8 11.5 21.0 7.4 37 36 A A - 0 0 50 123,-2.5 2,-0.3 -2,-0.5 92,-0.0 -0.501 27.1-171.6 -72.4 148.0 13.5 17.9 8.7 38 37 A V - 0 0 33 -2,-0.2 2,-0.2 121,-0.1 3,-0.1 -0.978 29.4-101.1-142.0 146.3 11.7 15.8 11.2 39 38 A H - 0 0 122 -2,-0.3 10,-0.3 1,-0.1 9,-0.1 -0.473 53.4 -95.0 -66.9 138.8 12.7 12.8 13.4 40 39 A D >> - 0 0 111 -2,-0.2 4,-1.3 1,-0.2 3,-0.8 -0.279 28.2-125.7 -58.1 140.2 11.6 9.5 12.0 41 40 A R T 34 S+ 0 0 177 1,-0.3 6,-0.2 2,-0.2 -1,-0.2 0.851 110.3 60.7 -54.7 -36.9 8.2 8.5 13.6 42 41 A K T 34 S+ 0 0 204 1,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.888 102.5 52.0 -58.6 -40.9 9.9 5.2 14.5 43 42 A E T <4 S+ 0 0 145 -3,-0.8 -2,-0.2 2,-0.0 -1,-0.2 0.983 120.1 17.5 -61.7 -64.4 12.5 6.9 16.7 44 43 A D S < S- 0 0 44 -4,-1.3 0, 0.0 1,-0.0 0, 0.0 -0.315 99.9 -83.5 -99.8-172.3 10.2 9.1 18.9 45 44 A G S S- 0 0 75 1,-0.1 -4,-0.1 -2,-0.1 -3,-0.1 0.455 76.2 -88.4 -70.3 4.1 6.5 8.9 19.6 46 45 A G S > S+ 0 0 8 -6,-0.2 4,-1.8 -5,-0.1 -1,-0.1 0.400 99.1 130.2 92.9 6.0 5.8 10.8 16.4 47 46 A L H > + 0 0 63 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.874 61.4 52.9 -64.0 -41.6 6.3 13.8 18.7 48 47 A D H > S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 108.0 53.2 -64.1 -40.8 8.8 15.7 16.6 49 48 A G H > S+ 0 0 4 -10,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.897 108.3 50.3 -56.8 -44.5 6.4 15.4 13.7 50 49 A K H X S+ 0 0 78 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.859 108.4 51.4 -65.6 -36.3 3.5 16.9 15.7 51 50 A R H X S+ 0 0 125 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.902 112.3 46.6 -68.3 -37.4 5.7 19.8 16.9 52 51 A V H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.911 111.4 50.9 -70.7 -42.3 6.6 20.6 13.3 53 52 A W H X S+ 0 0 74 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.934 108.7 53.0 -53.5 -47.6 3.0 20.3 12.2 54 53 A K H < S+ 0 0 80 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.936 110.9 46.3 -54.7 -47.8 2.0 22.7 15.1 55 54 A F H < S+ 0 0 8 -4,-2.1 39,-3.1 1,-0.2 -1,-0.2 0.895 115.0 46.5 -61.2 -47.2 4.6 25.2 13.8 56 55 A L H < S- 0 0 0 -4,-2.5 67,-0.5 37,-0.2 -1,-0.2 0.868 103.2-141.2 -64.1 -39.3 3.5 24.9 10.1 57 56 A G < - 0 0 0 -4,-2.6 35,-0.2 -5,-0.2 -1,-0.2 -0.419 13.4-100.1 97.6-179.6 -0.3 25.1 10.8 58 57 A F S S+ 0 0 16 33,-2.4 34,-0.2 14,-0.2 -1,-0.1 0.601 85.7 94.3-116.4 -26.4 -3.2 23.2 9.2 59 58 A N - 0 0 12 32,-2.4 65,-2.7 13,-0.1 2,-0.4 -0.428 61.9-147.8 -69.0 150.4 -4.6 25.7 6.6 60 59 A S E -G 70 0C 32 10,-1.9 9,-2.6 63,-0.2 10,-2.3 -0.973 12.3-169.8-129.3 140.8 -3.4 25.5 3.1 61 60 A Y E -G 68 0C 42 -2,-0.4 7,-0.2 7,-0.3 6,-0.1 -0.977 29.6-115.5-130.4 136.1 -2.9 28.1 0.4 62 61 A D >> - 0 0 25 5,-3.1 4,-2.8 -2,-0.4 3,-0.7 -0.582 19.4-149.2 -69.9 120.6 -2.1 27.7 -3.4 63 62 A P T 34 S+ 0 0 23 0, 0.0 72,-1.1 0, 0.0 -1,-0.2 0.746 90.9 67.0 -65.6 -19.8 1.3 29.2 -4.0 64 63 A R T 34 S- 0 0 126 70,-0.2 71,-0.1 1,-0.1 -2,-0.0 0.884 128.9 -5.2 -68.1 -38.6 0.3 30.1 -7.5 65 64 A D T <4 S- 0 0 105 -3,-0.7 -1,-0.1 2,-0.1 69,-0.0 0.379 92.4-110.7-139.5 0.6 -2.2 32.8 -6.5 66 65 A G < + 0 0 48 -4,-2.8 2,-0.0 1,-0.2 3,-0.0 0.467 61.1 155.7 82.2 1.2 -2.5 32.7 -2.7 67 66 A K - 0 0 139 -5,-0.3 -5,-3.1 -6,-0.1 2,-0.5 -0.340 49.7-113.3 -64.9 139.0 -6.0 31.2 -2.8 68 67 A Q E +G 61 0C 85 -7,-0.2 -7,-0.3 1,-0.2 3,-0.1 -0.599 43.3 164.6 -70.6 122.0 -7.0 29.3 0.4 69 68 A V E + 0 0 99 -9,-2.6 2,-0.4 -2,-0.5 -8,-0.2 0.451 62.9 49.2-117.3 -5.9 -7.4 25.6 -0.6 70 69 A G E +G 60 0C 17 -10,-2.3 -10,-1.9 2,-0.0 2,-0.4 -0.969 58.7 179.8-139.4 122.6 -7.4 24.1 2.9 71 70 A Y + 0 0 159 -2,-0.4 2,-0.4 -12,-0.2 -12,-0.1 -0.980 4.3 177.4-120.6 133.7 -9.4 25.2 5.9 72 71 A V - 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