==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 13-MAR-10 3M5R . COMPND 2 MOLECULE: NONSTRUCTURAL PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR D.H.FREMONT,Y.Y.L.YU,C.A.NELSON,CENTER FOR STRUCTURAL . 736 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36020.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 496 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 221 30.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 . 62 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 18.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 6 5 1 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 6 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 0 1 12 7 5 0 0 4 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 . 0 0 0 0 0 5 1 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 78 A H 0 0 175 0, 0.0 732,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 69.1 29.0 54.4 -16.0 2 79 A M - 0 0 63 1,-0.1 2,-0.2 628,-0.0 629,-0.1 -0.091 360.0-101.6 -66.5 148.3 27.6 57.7 -14.5 3 80 A T - 0 0 128 627,-0.2 2,-0.6 1,-0.1 -1,-0.1 -0.466 35.8-145.4 -63.2 133.8 27.6 58.6 -10.8 4 81 A I - 0 0 30 -2,-0.2 2,-0.3 626,-0.1 626,-0.2 -0.923 7.1-155.8-109.2 118.3 24.3 58.0 -9.2 5 82 A A E -A 629 0A 50 624,-3.2 624,-1.9 -2,-0.6 2,-0.5 -0.709 3.2-154.0 -88.4 142.5 23.0 60.4 -6.4 6 83 A S E -A 628 0A 29 -2,-0.3 622,-0.2 622,-0.2 253,-0.1 -0.959 12.5-171.6-120.3 110.8 20.5 59.1 -3.9 7 84 A V E -A 627 0A 74 620,-3.1 620,-2.6 -2,-0.5 -2,-0.0 -0.905 16.9-134.7-112.1 115.4 18.4 61.9 -2.4 8 85 A P E -A 626 0A 63 0, 0.0 2,-0.3 0, 0.0 618,-0.2 -0.286 23.7-172.3 -65.4 151.3 16.0 61.1 0.5 9 86 A T - 0 0 37 616,-2.0 616,-0.3 252,-0.2 3,-0.2 -0.829 32.8-130.7-132.5 172.4 12.4 62.3 0.5 10 87 A S S S+ 0 0 113 -2,-0.3 616,-0.1 1,-0.1 614,-0.0 0.047 74.7 112.7-108.5 25.7 9.6 62.4 3.0 11 88 A R + 0 0 25 614,-0.2 48,-1.9 1,-0.1 2,-0.9 0.557 49.3 92.8 -79.3 -6.7 7.1 61.0 0.4 12 89 A Y E -H 58 0B 42 46,-0.2 2,-0.3 -3,-0.2 46,-0.3 -0.767 60.2-168.1 -95.0 105.3 6.7 57.7 2.2 13 90 A L E -H 57 0B 35 44,-2.8 44,-2.0 -2,-0.9 2,-0.4 -0.676 2.4-164.9 -94.2 142.7 3.7 57.9 4.5 14 91 A S E +H 56 0B 70 -2,-0.3 42,-0.2 42,-0.2 4,-0.1 -0.951 25.4 167.6-134.3 117.4 2.9 55.3 7.1 15 92 A D S S+ 0 0 41 40,-1.9 2,-0.4 -2,-0.4 41,-0.2 0.683 74.6 65.3 -86.0 -26.5 -0.4 54.7 9.1 16 93 A M S S- 0 0 4 39,-0.2 2,-0.1 53,-0.1 53,-0.0 -0.785 83.8-122.5-103.8 143.5 0.9 51.3 10.3 17 94 A T > - 0 0 46 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.384 35.1-108.5 -66.2 156.1 3.8 50.5 12.6 18 95 A L H > S+ 0 0 42 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.850 123.8 56.0 -55.6 -33.1 6.4 48.2 11.1 19 96 A E H > S+ 0 0 93 2,-0.2 4,-3.0 1,-0.2 3,-0.5 0.970 106.1 46.5 -63.9 -53.3 5.0 45.7 13.5 20 97 A E H 4 S+ 0 0 27 1,-0.3 -2,-0.2 2,-0.2 -1,-0.2 0.861 114.1 51.2 -55.4 -36.9 1.4 46.0 12.1 21 98 A M H < S+ 0 0 28 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.840 116.9 39.2 -64.4 -36.0 3.0 45.8 8.7 22 99 A S H < S+ 0 0 78 -4,-1.8 -2,-0.2 -3,-0.5 -1,-0.2 0.770 89.2 115.3 -88.1 -30.2 4.9 42.6 9.6 23 100 A R < - 0 0 73 -4,-3.0 2,-0.5 -5,-0.1 -3,-0.0 0.156 59.5-131.9 -48.1 159.0 2.2 40.9 11.7 24 101 A D + 0 0 151 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.966 31.8 165.8-120.4 128.3 0.7 37.6 10.6 25 102 A W - 0 0 58 -2,-0.5 2,-0.4 53,-0.0 55,-0.1 -0.816 22.2-143.1-133.4 170.3 -3.0 37.0 10.6 26 103 A F - 0 0 161 -2,-0.3 2,-0.4 53,-0.2 3,-0.1 -1.000 17.4-126.3-138.8 138.2 -5.6 34.6 9.3 27 104 A M - 0 0 24 -2,-0.4 53,-0.1 1,-0.2 54,-0.0 -0.672 10.6-147.5 -75.7 132.9 -9.1 35.1 8.0 28 105 A L S S+ 0 0 121 -2,-0.4 -1,-0.2 1,-0.3 15,-0.0 0.989 102.8 17.7 -52.9 -58.7 -11.6 32.9 9.7 29 106 A M S S- 0 0 112 -3,-0.1 15,-3.7 2,-0.0 -1,-0.3 -0.830 97.9-154.5-120.3 87.3 -13.4 32.8 6.4 30 107 A P + 0 0 84 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.296 19.7 176.1 -80.1 143.4 -10.9 33.9 3.8 31 108 A R + 0 0 116 11,-0.3 11,-2.7 -2,-0.0 2,-0.4 -0.976 5.3 178.1-141.9 136.3 -11.6 35.5 0.4 32 109 A Q E +I 41 0B 95 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -1.000 3.2 169.7-142.5 127.9 -8.9 36.7 -1.9 33 110 A K E -I 40 0B 31 7,-2.7 7,-3.2 -2,-0.4 2,-0.6 -0.994 31.3-121.2-144.4 153.2 -9.2 38.2 -5.3 34 111 A I E -I 39 0B 116 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.833 21.4-173.6 -95.7 123.9 -7.0 40.0 -7.8 35 112 A I E > -I 38 0B 33 3,-3.2 3,-1.8 -2,-0.6 65,-0.1 -0.925 64.0 -57.8-117.3 101.1 -8.0 43.5 -8.8 36 113 A G T 3 S- 0 0 55 -2,-0.6 56,-0.1 1,-0.3 60,-0.0 -0.443 121.1 -16.1 60.1-130.9 -5.7 44.6 -11.6 37 114 A P T 3 S+ 0 0 22 0, 0.0 49,-1.5 0, 0.0 2,-0.3 0.240 126.3 84.6 -86.5 13.9 -2.1 44.4 -10.3 38 115 A L E < -IJ 35 85B 0 -3,-1.8 -3,-3.2 47,-0.2 2,-0.5 -0.874 67.9-138.6-123.2 150.9 -3.3 44.2 -6.7 39 116 A C E -IJ 34 84B 6 45,-2.8 45,-2.2 -2,-0.3 2,-0.5 -0.924 16.7-163.7-106.9 125.1 -4.5 41.5 -4.3 40 117 A V E -IJ 33 83B 0 -7,-3.2 -7,-2.7 -2,-0.5 2,-0.4 -0.935 6.0-172.8-111.4 126.9 -7.5 42.2 -2.1 41 118 A R E +IJ 32 82B 53 41,-3.1 41,-2.3 -2,-0.5 2,-0.3 -0.966 6.0 174.4-118.5 138.6 -8.1 40.0 0.9 42 119 A L E - J 0 81B 0 -11,-2.7 2,-0.6 -2,-0.4 -11,-0.3 -0.947 32.2-127.0-148.1 124.8 -11.2 40.1 3.2 43 120 A D > - 0 0 7 37,-2.9 3,-0.9 -2,-0.3 -2,-0.0 -0.584 18.7-154.7 -69.6 116.2 -12.4 37.9 6.0 44 121 A Q T 3 S+ 0 0 41 -15,-3.7 -1,-0.2 -2,-0.6 36,-0.0 0.544 86.0 64.8 -72.6 -7.8 -15.9 37.0 5.1 45 122 A A T 3 S+ 0 0 40 -16,-0.2 2,-0.4 35,-0.1 -1,-0.2 0.778 76.2 98.7 -86.0 -28.1 -16.9 36.4 8.7 46 123 A I < + 0 0 21 -3,-0.9 2,-0.3 34,-0.2 67,-0.2 -0.472 49.8 157.9 -73.7 117.3 -16.5 40.0 9.9 47 124 A M + 0 0 76 -2,-0.4 65,-0.2 1,-0.1 3,-0.1 -0.961 50.3 10.3-139.2 155.5 -19.8 41.8 10.0 48 125 A E S S+ 0 0 163 63,-1.9 2,-0.3 -2,-0.3 65,-0.2 0.745 88.7 131.2 50.7 32.4 -21.4 44.8 11.7 49 126 A K - 0 0 92 62,-0.2 65,-2.7 -3,-0.1 2,-0.6 -0.756 66.3-110.2-106.5 159.0 -18.0 46.1 13.1 50 127 A N E -k 114 0B 77 -2,-0.3 2,-0.4 63,-0.2 25,-0.4 -0.805 44.8-169.7 -82.6 121.2 -16.4 49.5 13.0 51 128 A I E -k 115 0B 2 63,-3.8 65,-2.6 -2,-0.6 2,-0.4 -0.947 14.1-162.5-123.1 133.2 -13.5 49.1 10.7 52 129 A V E -kL 116 73B 14 21,-2.2 21,-2.7 -2,-0.4 2,-0.5 -0.950 11.9-143.7-113.9 135.8 -10.6 51.5 9.9 53 130 A L E -kL 117 72B 0 63,-2.4 65,-1.9 -2,-0.4 2,-0.4 -0.858 20.6-179.0 -96.7 125.9 -8.4 51.3 6.9 54 131 A K E - L 0 71B 50 17,-2.6 17,-2.8 -2,-0.5 2,-0.3 -0.959 4.5-176.2-122.5 144.9 -4.7 52.1 7.4 55 132 A A E - L 0 70B 1 -2,-0.4 -40,-1.9 15,-0.2 2,-0.5 -0.955 24.6-146.5-141.1 155.2 -2.0 52.1 4.7 56 133 A N E +HL 14 69B 2 13,-2.6 12,-2.5 -2,-0.3 13,-1.6 -0.992 43.8 135.9-120.2 120.6 1.7 52.6 4.1 57 134 A F E -HL 13 67B 1 -44,-2.0 -44,-2.8 -2,-0.5 2,-0.3 -0.984 48.4-113.7-158.8 158.6 2.5 54.2 0.7 58 135 A S E -HL 12 66B 0 8,-2.4 7,-3.3 -2,-0.3 8,-0.9 -0.710 29.1-152.9 -95.1 156.6 4.6 56.7 -1.1 59 136 A V E + L 0 64B 17 -48,-1.9 2,-0.3 5,-0.3 5,-0.2 -0.884 16.2 171.1-123.0 160.7 3.1 59.8 -2.8 60 137 A I E > + L 0 63B 10 3,-2.6 3,-1.8 -2,-0.3 -2,-0.0 -0.943 69.0 18.9-162.7 150.0 4.1 62.0 -5.7 61 138 A F T 3 S- 0 0 61 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.852 130.7 -66.6 52.0 33.2 2.5 64.8 -7.6 62 139 A N T 3 S+ 0 0 90 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.657 119.4 91.6 66.1 22.4 0.2 65.0 -4.6 63 140 A R E < S-L 60 0B 65 -3,-1.8 -3,-2.6 62,-0.0 -1,-0.2 -0.897 92.0 -76.6-135.3 161.1 -1.4 61.6 -5.2 64 141 A L E -L 59 0B 2 60,-2.1 30,-0.4 -2,-0.3 -5,-0.3 -0.413 43.8-177.4 -55.7 137.5 -0.5 58.1 -4.0 65 142 A E E - 0 0 9 -7,-3.3 2,-0.4 1,-0.3 -6,-0.2 0.817 63.5 -1.7-100.4 -62.3 2.5 56.8 -6.0 66 143 A T E -L 58 0B 9 -8,-0.9 -8,-2.4 27,-0.1 2,-0.5 -0.997 63.0-138.6-138.9 132.5 3.0 53.2 -4.8 67 144 A L E +L 57 0B 2 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.756 17.0 178.0 -86.8 128.1 1.2 51.1 -2.2 68 145 A I E - 0 0 23 -12,-2.5 2,-0.3 -2,-0.5 -11,-0.2 0.864 69.9 -25.7 -87.3 -52.0 3.3 49.0 0.1 69 146 A L E -L 56 0B 19 -13,-1.6 -13,-2.6 15,-0.1 2,-0.4 -0.953 48.6-165.0-163.3 140.6 0.4 47.7 2.2 70 147 A L E -LM 55 83B 2 13,-2.1 13,-2.5 -2,-0.3 2,-0.3 -0.995 15.7-176.5-125.2 137.2 -3.1 48.5 3.4 71 148 A R E -LM 54 82B 18 -17,-2.8 -17,-2.6 -2,-0.4 2,-0.4 -0.985 20.4-137.6-134.1 146.6 -4.8 46.7 6.2 72 149 A A E -LM 53 81B 0 9,-2.1 8,-2.9 -2,-0.3 9,-1.0 -0.876 26.5-165.5-102.9 133.3 -8.3 46.9 7.7 73 150 A F E -LM 52 79B 0 -21,-2.7 -21,-2.2 -2,-0.4 6,-0.2 -0.935 16.6-136.4-125.8 140.4 -8.5 46.8 11.5 74 151 A T > - 0 0 11 4,-2.6 3,-1.1 -2,-0.4 -23,-0.1 -0.263 46.6 -93.9 -74.8 176.0 -11.2 46.3 14.1 75 152 A E T 3 S+ 0 0 145 -25,-0.4 -1,-0.1 1,-0.3 -24,-0.1 0.761 129.3 58.2 -65.8 -22.9 -11.3 48.6 17.1 76 153 A E T 3 S- 0 0 160 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.712 122.1-108.8 -74.6 -21.4 -9.3 45.9 18.9 77 154 A G < + 0 0 22 -3,-1.1 2,-0.3 1,-0.3 -2,-0.1 0.650 69.4 147.4 95.8 19.1 -6.6 46.2 16.3 78 155 A A - 0 0 48 1,-0.0 -4,-2.6 -53,-0.0 2,-0.4 -0.696 49.9-118.9 -83.8 141.6 -7.3 42.9 14.7 79 156 A I E + M 0 73B 14 -2,-0.3 -6,-0.2 -6,-0.2 -53,-0.2 -0.647 38.3 164.8 -84.1 132.3 -6.7 42.6 11.0 80 157 A V E + 0 0 2 -8,-2.9 -37,-2.9 -2,-0.4 2,-0.3 0.477 64.0 8.3-121.5 -8.1 -9.8 41.8 8.9 81 158 A G E -JM 42 72B 0 -9,-1.0 -9,-2.1 -39,-0.2 2,-0.3 -0.977 57.5-168.7-167.1 168.3 -8.6 42.7 5.4 82 159 A E E -JM 41 71B 14 -41,-2.3 -41,-3.1 -2,-0.3 2,-0.4 -0.986 14.8-152.2-166.8 149.2 -5.7 43.8 3.3 83 160 A I E +JM 40 70B 0 -13,-2.5 -13,-2.1 -2,-0.3 -43,-0.2 -0.992 29.7 164.6-128.2 124.7 -4.6 45.1 -0.1 84 161 A S E -J 39 0B 16 -45,-2.2 -45,-2.8 -2,-0.4 -15,-0.1 -0.952 40.9 -95.5-137.2 159.3 -1.0 44.2 -1.3 85 162 A P E -J 38 0B 31 0, 0.0 -47,-0.2 0, 0.0 7,-0.0 -0.402 51.2-100.8 -66.4 150.0 1.0 44.3 -4.5 86 163 A L > - 0 0 28 -49,-1.5 3,-3.4 1,-0.1 5,-0.2 -0.482 31.1-114.3 -68.2 145.9 1.1 41.0 -6.3 87 164 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.762 118.7 68.0 -55.8 -28.0 4.4 39.1 -5.7 88 165 A S T 3 S- 0 0 103 -51,-0.0 -2,-0.0 1,-0.0 0, 0.0 0.823 99.5-145.0 -51.0 -31.3 5.2 39.6 -9.4 89 166 A L < + 0 0 90 -3,-3.4 3,-0.1 -52,-0.1 -51,-0.1 0.985 28.6 177.5 55.0 61.1 5.4 43.2 -8.2 90 167 A P - 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