==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-JUN-11 3SON . COMPND 2 MOLECULE: HYPOTHETICAL NUDIX HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 291 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14502.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 22.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 16 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 21.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 2 0 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 2 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 . 3 2 2 2 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 3 A Q 0 0 135 0, 0.0 36,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 85.4 19.9 26.0 71.2 2 4 A P + 0 0 55 0, 0.0 2,-0.3 0, 0.0 36,-0.1 -0.360 360.0 166.3 -72.3 154.2 22.3 23.4 69.8 3 5 A F - 0 0 30 82,-0.2 34,-2.4 34,-0.1 2,-0.3 -0.965 24.6-130.6-155.7 169.9 21.1 19.9 69.0 4 6 A Q E -Ab 36 87A 20 82,-2.7 84,-2.6 -2,-0.3 2,-0.4 -0.828 11.6-146.9-125.4 153.7 22.1 16.8 67.2 5 7 A V E -Ab 35 88A 0 30,-2.6 30,-1.7 -2,-0.3 2,-0.4 -0.929 3.3-161.5-119.8 151.0 20.5 14.5 64.7 6 8 A L E -Ab 34 89A 3 82,-2.3 84,-2.0 -2,-0.4 2,-0.4 -0.985 9.1-168.8-123.3 137.4 20.7 10.8 64.2 7 9 A V E -Ab 33 90A 0 26,-2.3 26,-2.1 -2,-0.4 84,-0.3 -0.979 6.6-159.4-134.2 121.8 19.6 9.2 60.9 8 10 A I E - b 0 91A 0 82,-2.7 84,-2.1 -2,-0.4 2,-0.2 -0.882 12.0-148.5-102.1 112.7 19.2 5.4 60.3 9 11 A P E + b 0 92A 0 0, 0.0 11,-2.2 0, 0.0 2,-0.3 -0.544 22.8 177.5 -74.7 146.5 19.3 4.3 56.7 10 12 A F E -Cb 19 93A 3 82,-2.5 84,-2.7 9,-0.2 2,-0.3 -0.988 16.6-160.0-146.1 158.7 17.1 1.3 55.8 11 13 A I E -C 18 0A 18 7,-2.5 7,-2.6 -2,-0.3 2,-0.6 -0.988 19.9-128.8-135.8 143.2 16.2 -0.9 52.7 12 14 A K E -C 17 0A 115 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.866 29.7-171.1 -88.2 118.8 13.3 -3.2 52.1 13 15 A T - 0 0 45 3,-2.7 82,-0.0 -2,-0.6 0, 0.0 -0.509 40.7-100.4 -96.7 173.4 14.5 -6.6 50.8 14 16 A E S S+ 0 0 115 -2,-0.2 -1,-0.1 1,-0.1 3,-0.0 0.953 122.2 29.7 -57.2 -46.4 12.4 -9.5 49.4 15 17 A A S S- 0 0 100 -3,-0.0 2,-0.1 1,-0.0 -1,-0.1 0.984 129.1 -30.7 -75.1 -62.1 12.7 -11.2 52.8 16 18 A N S S- 0 0 74 -5,-0.0 -3,-2.7 0, 0.0 2,-0.4 -0.356 71.8 -69.9-140.7-160.4 13.1 -8.6 55.5 17 19 A Y E -C 12 0A 41 -5,-0.2 98,-0.4 -2,-0.1 2,-0.3 -0.919 38.1-157.0-110.5 145.8 14.4 -5.1 56.2 18 20 A Q E -C 11 0A 65 -7,-2.6 -7,-2.5 -2,-0.4 2,-0.4 -0.927 5.9-143.4-118.6 157.0 18.0 -4.3 56.4 19 21 A F E -CD 10 113A 1 94,-2.9 94,-2.7 -2,-0.3 2,-0.6 -0.902 13.2-127.6-127.4 139.6 19.7 -1.4 58.2 20 22 A G E + D 0 112A 0 -11,-2.2 2,-0.4 -2,-0.4 92,-0.2 -0.763 26.9 179.9 -94.9 115.6 22.6 0.6 57.1 21 23 A V E - D 0 111A 0 90,-2.6 90,-2.8 -2,-0.6 2,-0.4 -0.956 16.3-141.2-116.3 150.5 25.6 1.0 59.5 22 24 A L E -ED 31 110A 0 9,-3.0 9,-2.6 -2,-0.4 2,-0.4 -0.892 3.0-147.9-116.6 131.3 28.8 2.9 58.9 23 25 A H E -ED 30 109A 31 86,-2.4 85,-2.8 -2,-0.4 86,-0.9 -0.822 25.8-120.6 -98.2 133.1 32.2 2.0 59.9 24 26 A R E - D 0 107A 46 5,-2.6 83,-0.3 -2,-0.4 5,-0.2 -0.416 4.4-142.7 -73.3 144.5 34.5 4.8 60.8 25 27 A T S S+ 0 0 86 81,-2.6 82,-0.2 1,-0.2 -1,-0.1 0.908 100.4 39.7 -64.9 -42.8 37.8 5.4 58.9 26 28 A D S S+ 0 0 114 80,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.408 122.1 26.7 -95.7 3.3 39.8 6.5 62.0 27 29 A A S S- 0 0 40 -3,-0.2 2,-2.0 2,-0.2 -3,-0.3 -0.988 81.5-105.9-161.2 150.1 38.4 4.1 64.6 28 30 A D S S+ 0 0 140 -2,-0.3 2,-0.4 -5,-0.1 -3,-0.1 -0.537 77.2 128.4 -80.3 76.2 36.9 0.6 64.9 29 31 A V - 0 0 29 -2,-2.0 -5,-2.6 -5,-0.2 2,-0.4 -0.998 47.9-153.6-139.9 132.3 33.5 2.2 65.5 30 32 A W E +E 23 0A 28 91,-0.5 93,-0.4 -2,-0.4 2,-0.3 -0.898 30.8 152.1-111.4 134.2 30.1 1.5 63.8 31 33 A Q E -E 22 0A 38 -9,-2.6 -9,-3.0 -2,-0.4 2,-0.1 -0.951 38.2-109.9-149.5 172.2 27.5 4.3 63.8 32 34 A F - 0 0 1 -2,-0.3 2,-0.2 -11,-0.2 -24,-0.2 -0.312 59.0 -65.4 -94.0 178.3 24.6 5.9 62.0 33 35 A V E +A 7 0A 0 -26,-2.1 -26,-2.3 -2,-0.1 2,-0.3 -0.548 68.2 172.9 -61.3 132.5 24.4 9.2 60.1 34 36 A A E +A 6 0A 29 -2,-0.2 2,-0.3 -28,-0.2 -28,-0.2 -0.999 9.5 137.3-148.4 147.4 25.0 12.0 62.8 35 37 A G E -A 5 0A 10 -30,-1.7 -30,-2.6 -2,-0.3 2,-0.2 -0.950 38.8 -99.8-176.6 169.4 25.5 15.7 62.9 36 38 A G E -A 4 0A 21 -2,-0.3 -32,-0.2 -32,-0.2 2,-0.1 -0.577 39.0 -96.5-105.2 156.6 24.7 18.9 64.6 37 39 A G - 0 0 31 -34,-2.4 2,-0.3 -2,-0.2 -34,-0.1 -0.395 39.9-160.0 -62.5 139.2 22.4 21.8 63.8 38 40 A E > - 0 0 92 -2,-0.1 3,-2.3 -36,-0.1 8,-0.0 -0.923 46.4 -30.9-121.1 151.6 23.9 24.7 62.0 39 41 A D T 3 S- 0 0 169 -2,-0.3 -2,-0.0 1,-0.3 0, 0.0 -0.157 122.2 -23.0 53.8-120.4 22.8 28.4 61.6 40 42 A E T 3 S+ 0 0 99 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.043 91.9 155.1-112.1 28.6 19.0 28.7 61.7 41 43 A E < - 0 0 41 -3,-2.3 2,-0.2 1,-0.1 -4,-0.1 -0.151 43.3-131.7 -62.6 137.0 18.2 25.1 60.6 42 44 A A > - 0 0 44 1,-0.1 4,-1.8 -5,-0.0 3,-0.4 -0.557 34.5-111.0 -71.7 157.6 15.0 23.3 61.5 43 45 A I H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.829 119.6 54.8 -60.2 -39.6 15.9 19.9 62.9 44 46 A S H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.821 105.7 52.8 -61.6 -34.7 14.4 18.2 59.7 45 47 A E H > S+ 0 0 109 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.862 108.1 49.9 -72.0 -39.0 16.7 20.3 57.6 46 48 A T H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.920 110.2 51.0 -57.8 -49.1 19.8 19.2 59.6 47 49 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.938 113.2 46.0 -57.3 -45.2 18.8 15.6 59.2 48 50 A K H X S+ 0 0 91 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.931 114.0 47.5 -61.2 -52.5 18.4 16.1 55.4 49 51 A R H X S+ 0 0 43 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.909 113.3 47.0 -55.6 -47.1 21.7 17.9 55.1 50 52 A E H X S+ 0 0 15 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.839 111.5 51.6 -67.3 -39.6 23.7 15.4 57.1 51 53 A S H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.3 6,-0.2 0.912 112.3 46.1 -61.5 -48.0 22.2 12.5 55.2 52 54 A I H X>S+ 0 0 58 -4,-2.6 4,-1.3 2,-0.2 5,-0.5 0.905 114.0 48.9 -60.3 -41.9 23.1 14.2 51.9 53 55 A E H <5S+ 0 0 91 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.950 117.7 39.1 -65.3 -45.6 26.7 14.9 53.2 54 56 A E H <5S+ 0 0 10 -4,-2.7 50,-0.7 1,-0.2 -1,-0.2 0.799 126.7 31.9 -79.9 -29.3 27.4 11.4 54.5 55 57 A L H <5S- 0 0 0 -4,-2.0 47,-1.8 -5,-0.2 -1,-0.2 0.395 95.6-130.5-108.7 2.5 25.7 9.3 51.7 56 58 A N T <5 + 0 0 80 -4,-1.3 2,-0.2 45,-0.2 -3,-0.1 0.914 47.0 170.9 44.6 56.5 26.3 11.7 48.7 57 59 A L < - 0 0 15 -5,-0.5 -1,-0.2 -6,-0.2 4,-0.1 -0.627 36.5-110.5 -96.6 151.2 22.7 11.5 47.6 58 60 A D - 0 0 82 -2,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.179 52.8 -82.6 -56.7-166.9 20.8 13.5 45.0 59 61 A V S S+ 0 0 113 1,-0.2 2,-0.6 -7,-0.0 -7,-0.1 0.811 103.3 58.1 -81.8 -32.0 18.1 16.0 46.2 60 62 A D + 0 0 135 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.835 55.0 144.7-119.1 103.9 14.9 14.0 47.0 61 63 A V - 0 0 23 -2,-0.6 2,-0.6 -3,-0.1 33,-0.1 -0.974 51.0-106.1-132.3 146.1 14.6 11.1 49.4 62 64 A K - 0 0 49 31,-0.4 31,-2.0 -2,-0.3 2,-0.3 -0.611 39.6-173.3 -75.2 113.5 11.9 9.9 51.8 63 65 A X E -F 92 0A 11 -2,-0.6 83,-1.3 29,-0.2 2,-0.3 -0.765 3.7-160.0-102.5 151.3 12.8 10.8 55.4 64 66 A Y E -FG 91 145A 51 27,-2.3 27,-2.2 -2,-0.3 2,-0.3 -0.975 12.9-123.0-134.1 149.0 10.9 9.6 58.4 65 67 A S E -F 90 0A 28 79,-2.8 79,-0.4 -2,-0.3 2,-0.3 -0.680 18.2-161.2 -91.9 143.7 10.6 10.8 62.0 66 68 A L E - 0 0 16 23,-2.1 23,-0.4 -2,-0.3 64,-0.1 -0.903 19.0-141.7-117.9 148.7 11.2 8.7 65.2 67 69 A D E + 0 0 74 -2,-0.3 -1,-0.1 63,-0.1 63,-0.1 0.667 68.9 111.2 -75.2 -21.9 10.1 9.4 68.8 68 70 A S E + 0 0 4 62,-0.1 21,-0.8 61,-0.1 2,-0.3 -0.346 43.8 168.7 -63.2 129.6 13.3 8.1 70.3 69 71 A H E -F 88 0A 26 19,-0.1 148,-1.6 -2,-0.1 2,-0.3 -0.993 11.6-178.7-141.6 146.9 15.3 11.0 71.8 70 72 A A E -FH 87 216A 10 17,-1.4 17,-2.5 -2,-0.3 2,-0.3 -0.974 24.5-123.9-143.6 155.6 18.3 11.2 74.1 71 73 A S E -F 86 0A 13 144,-0.7 204,-0.1 -2,-0.3 55,-0.1 -0.761 25.6-160.2 -94.6 146.4 20.5 13.8 75.8 72 74 A I E -F 85 0A 23 13,-2.4 13,-2.4 -2,-0.3 5,-0.1 -0.996 32.8 -99.9-126.8 139.5 24.2 13.9 75.1 73 75 A P E > -F 84 0A 13 0, 0.0 3,-1.6 0, 0.0 11,-0.3 -0.349 36.1-140.2 -51.9 120.5 27.0 15.5 77.2 74 76 A N G >> S+ 0 0 4 9,-2.5 4,-3.0 1,-0.3 3,-2.7 0.737 91.4 82.9 -69.7 -15.3 27.4 18.5 75.1 75 77 A F G 34 S+ 0 0 122 8,-0.5 -1,-0.3 1,-0.3 9,-0.1 0.709 79.4 67.0 -58.5 -25.5 31.2 18.3 75.5 76 78 A H G <4 S+ 0 0 105 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.732 123.0 14.0 -55.1 -24.8 31.2 15.8 72.6 77 79 A F T <4 S+ 0 0 89 -3,-2.7 2,-0.3 1,-0.3 -2,-0.2 0.603 126.3 29.3-131.2 -28.9 30.1 18.7 70.4 78 80 A S < - 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0 0 87 -47,-1.8 2,-0.2 -2,-0.2 -2,-0.0 -0.986 25.6-125.6-131.3 148.7 28.9 6.8 48.2 103 105 A L - 0 0 48 -2,-0.3 -48,-0.2 1,-0.1 2,-0.1 -0.535 12.5-122.5 -98.0 155.2 30.6 7.6 51.5 104 106 A S > - 0 0 38 -50,-0.7 3,-1.7 -2,-0.2 -1,-0.1 -0.352 44.1 -92.3 -76.6 171.1 32.6 10.6 52.6 105 107 A L T 3 S+ 0 0 166 1,-0.2 -80,-0.1 -2,-0.1 -2,-0.0 0.663 117.6 76.9 -63.2 -15.0 36.2 10.1 53.9 106 108 A E T 3 S+ 0 0 89 -81,-0.1 -81,-2.6 -82,-0.1 -80,-0.4 0.733 96.2 54.0 -65.9 -21.2 34.9 9.8 57.5 107 109 A H E < -D 24 0A 10 -3,-1.7 -83,-0.3 -83,-0.3 3,-0.1 -0.875 53.7-167.6-125.3 148.8 33.7 6.2 56.7 108 110 A S E S+ 0 0 73 -85,-2.8 2,-0.3 1,-0.3 -84,-0.1 0.547 76.3 9.1-106.3 -12.9 35.2 3.0 55.4 109 111 A E E -D 23 0A 72 -86,-0.9 -86,-2.4 2,-0.0 2,-0.5 -0.938 48.4-149.6-167.8 140.2 32.1 1.0 54.8 110 112 A L E -D 22 0A 36 -2,-0.3 2,-0.5 -88,-0.2 -88,-0.2 -0.985 28.8-166.3-106.4 125.0 28.3 1.1 54.7 111 113 A R E -D 21 0A 101 -90,-2.8 -90,-2.6 -2,-0.5 2,-0.6 -0.982 15.1-147.1-117.5 130.1 27.0 -2.4 55.7 112 114 A W E +D 20 0A 59 -2,-0.5 2,-0.3 -92,-0.2 -92,-0.2 -0.855 36.7 164.1 -95.1 113.8 23.4 -3.5 55.2 113 115 A V E -D 19 0A 13 -94,-2.7 -94,-2.9 -2,-0.6 -2,-0.0 -0.878 38.6 -94.7-134.2 161.8 22.6 -5.8 58.1 114 116 A S > - 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