==== 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 OXIDOREDUCTASE 03-AUG-10 2XNJ . COMPND 2 MOLECULE: FERREDOXIN NADP-H REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.BOTTI,M.A.MUSUMECI,E.A.CECCARELLI,A.BUSCHIAZZO . 505 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24604.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 346 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 15.4 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 . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 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 . 40 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 2 4 0 0 2 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 0 2 2 2 2 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 . 2 2 2 0 2 4 0 2 0 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 . 2 0 0 0 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 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 2 A A 0 0 105 0, 0.0 2,-0.5 0, 0.0 101,-0.0 0.000 360.0 360.0 360.0 118.1 52.9 6.7 -13.3 2 3 A D - 0 0 107 99,-0.0 98,-2.9 2,-0.0 2,-0.4 -0.925 360.0-141.2-105.3 124.2 49.3 6.0 -12.0 3 4 A W E -A 99 0A 57 -2,-0.5 2,-0.3 96,-0.2 96,-0.2 -0.755 19.6-174.3 -90.9 132.3 48.3 7.6 -8.6 4 5 A V E -A 98 0A 32 94,-3.2 94,-2.7 -2,-0.4 2,-0.5 -0.867 30.1-106.0-120.5 157.5 46.2 5.6 -6.2 5 6 A T E -A 97 0A 86 -2,-0.3 2,-0.3 92,-0.2 92,-0.2 -0.737 38.1-167.6 -86.0 128.1 44.6 6.6 -2.9 6 7 A G E -A 96 0A 2 90,-3.1 90,-1.9 -2,-0.5 2,-0.4 -0.765 12.1-141.0-113.0 158.6 46.4 5.1 0.1 7 8 A K E -AB 95 24A 83 17,-2.7 17,-2.7 -2,-0.3 2,-0.3 -0.991 15.4-130.7-125.5 123.9 45.3 4.9 3.8 8 9 A V E + B 0 23A 0 86,-2.8 85,-3.4 -2,-0.4 15,-0.2 -0.601 29.6 171.9 -71.4 124.0 47.7 5.4 6.7 9 10 A T E + 0 0 17 13,-2.7 2,-0.3 1,-0.4 14,-0.2 0.582 64.1 14.1-107.7 -20.4 47.1 2.5 9.2 10 11 A K E - B 0 22A 108 12,-1.2 12,-2.5 81,-0.1 2,-0.4 -0.973 52.7-163.9-157.3 144.3 50.0 3.0 11.6 11 12 A V E - B 0 21A 32 -2,-0.3 2,-0.6 10,-0.2 10,-0.2 -0.992 10.7-167.1-130.8 121.2 52.5 5.7 12.4 12 13 A Q E - B 0 20A 72 8,-2.6 8,-2.2 -2,-0.4 2,-1.0 -0.963 7.0-157.5-112.9 112.7 55.6 4.6 14.5 13 14 A N E + B 0 19A 103 -2,-0.6 6,-0.2 6,-0.2 3,-0.1 -0.808 15.8 174.9 -94.9 93.3 57.6 7.6 15.9 14 15 A W S S- 0 0 86 -2,-1.0 2,-0.2 4,-0.7 -1,-0.2 0.905 71.8 -14.1 -62.7 -48.0 61.0 6.1 16.5 15 16 A T S S- 0 0 30 3,-2.0 141,-0.0 -3,-0.2 -1,-0.0 -0.693 87.6 -81.0-134.1-166.9 62.5 9.5 17.5 16 17 A D S S+ 0 0 162 -2,-0.2 3,-0.0 1,-0.1 -2,-0.0 0.739 132.1 25.2 -68.8 -27.3 61.3 13.2 17.1 17 18 A A S S+ 0 0 29 1,-0.1 51,-2.0 50,-0.1 2,-0.4 0.676 111.5 73.1-111.9 -27.0 62.6 13.2 13.5 18 19 A L E + C 0 67A 11 49,-0.2 -3,-2.0 47,-0.0 -4,-0.7 -0.827 55.6 155.6-100.3 132.3 62.4 9.4 12.4 19 20 A F E -BC 13 66A 2 47,-2.2 47,-3.0 -2,-0.4 2,-0.4 -0.987 29.7-144.7-151.8 150.2 59.1 7.7 11.7 20 21 A S E -BC 12 65A 2 -8,-2.2 -8,-2.6 -2,-0.3 2,-0.4 -0.962 13.7-154.3-119.2 138.1 57.7 4.8 9.7 21 22 A L E -BC 11 64A 0 43,-2.1 43,-2.4 -2,-0.4 2,-0.5 -0.921 3.0-153.1-107.9 140.5 54.2 4.8 8.1 22 23 A T E -BC 10 63A 22 -12,-2.5 -13,-2.7 -2,-0.4 -12,-1.2 -0.956 24.0-171.6-110.1 131.1 52.2 1.7 7.3 23 24 A V E -BC 8 62A 0 39,-2.7 39,-2.1 -2,-0.5 2,-0.6 -0.975 26.3-148.8-131.1 143.5 49.9 2.2 4.4 24 25 A H E +B 7 0A 40 -17,-2.7 -17,-2.7 -2,-0.4 37,-0.1 -0.953 39.7 147.1-106.0 118.4 47.1 0.3 2.6 25 26 A A - 0 0 19 -2,-0.6 2,-2.6 35,-0.4 -19,-0.2 -0.966 57.1-115.5-150.7 142.1 47.1 1.2 -1.1 26 27 A P + 0 0 94 0, 0.0 2,-0.1 0, 0.0 74,-0.1 -0.339 58.3 158.5 -79.2 62.9 46.2 -0.9 -4.2 27 28 A V - 0 0 30 -2,-2.6 74,-0.2 33,-0.1 73,-0.1 -0.386 42.9-106.6 -78.9 164.8 49.8 -0.8 -5.5 28 29 A L - 0 0 85 72,-3.2 74,-0.2 1,-0.1 -1,-0.1 -0.563 47.8 -79.2 -88.8 158.0 51.1 -3.4 -8.0 29 30 A P - 0 0 128 0, 0.0 73,-0.3 0, 0.0 2,-0.3 -0.193 56.5-163.9 -54.8 145.5 53.6 -6.2 -7.0 30 31 A F - 0 0 19 27,-0.2 2,-0.4 71,-0.1 71,-0.0 -0.870 23.0-107.1-132.1 164.7 57.1 -4.9 -6.7 31 32 A T > - 0 0 66 -2,-0.3 3,-2.0 73,-0.1 101,-0.1 -0.799 47.9-101.8 -92.0 133.5 60.7 -6.2 -6.5 32 33 A A T 3 S+ 0 0 9 -2,-0.4 76,-0.5 1,-0.3 3,-0.1 -0.334 111.2 37.2 -58.4 130.4 62.3 -6.0 -3.0 33 34 A G T 3 S+ 0 0 0 1,-0.4 73,-0.3 20,-0.4 -1,-0.3 0.092 93.3 117.9 108.7 -14.2 64.7 -2.9 -3.0 34 35 A Q < - 0 0 32 -3,-2.0 19,-1.8 94,-0.1 -1,-0.4 -0.282 49.5-146.9 -80.3 167.3 62.4 -0.8 -5.2 35 36 A F E -DE 52 103A 50 68,-2.3 68,-2.6 17,-0.3 17,-0.3 -0.801 8.4-165.3-125.8 168.0 60.7 2.5 -4.3 36 37 A T E -D 51 0A 2 15,-2.5 15,-2.5 -2,-0.3 2,-0.4 -0.685 29.5 -96.0-133.3-166.3 57.5 4.3 -5.2 37 38 A K E -D 50 0A 68 13,-0.3 62,-1.9 -2,-0.2 2,-0.4 -0.963 22.8-156.1-120.8 139.4 56.3 7.9 -4.8 38 39 A L E -DF 49 98A 0 11,-2.2 11,-2.0 -2,-0.4 2,-0.3 -0.867 18.2-170.7-108.4 143.1 54.2 9.3 -2.0 39 40 A G E +DF 48 97A 0 58,-2.4 58,-2.8 -2,-0.4 2,-0.3 -0.995 14.9 178.7-139.8 145.8 52.2 12.5 -2.6 40 41 A L E -D 47 0A 22 7,-1.8 7,-2.5 -2,-0.3 2,-0.5 -0.987 36.8-110.4-139.6 148.0 50.1 15.0 -0.7 41 42 A E E +D 46 0A 105 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.681 39.3 178.8 -79.1 120.6 48.2 18.1 -1.9 42 43 A I E > S-D 45 0A 9 3,-3.1 3,-1.7 -2,-0.5 -2,-0.0 -0.994 70.3 -14.1-129.8 118.3 50.1 21.2 -0.5 43 44 A D T 3 S- 0 0 143 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.884 130.5 -52.1 53.2 46.4 48.8 24.7 -1.4 44 45 A G T 3 S+ 0 0 70 1,-0.1 2,-0.4 -3,-0.0 -1,-0.3 0.378 122.0 97.5 75.5 0.6 46.5 23.2 -4.1 45 46 A E E < S-D 42 0A 146 -3,-1.7 -3,-3.1 -5,-0.1 2,-0.4 -0.941 77.4-116.4-122.1 141.1 49.3 21.2 -5.9 46 47 A R E -D 41 0A 99 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.612 28.6-161.1 -74.7 127.1 50.4 17.6 -5.5 47 48 A V E -D 40 0A 13 -7,-2.5 -7,-1.8 -2,-0.4 2,-0.4 -0.968 13.4-172.1-109.3 124.8 54.0 17.4 -4.1 48 49 A Q E +D 39 0A 69 -2,-0.5 2,-0.3 -9,-0.2 -9,-0.2 -0.958 13.1 171.3-127.0 142.8 55.6 14.1 -4.7 49 50 A R E -D 38 0A 112 -11,-2.0 -11,-2.2 -2,-0.4 2,-0.3 -0.952 36.3-100.8-141.2 160.2 58.9 12.4 -3.5 50 51 A A E +D 37 0A 51 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.3 -0.642 36.2 179.1 -85.8 139.1 60.4 8.9 -3.7 51 52 A Y E -D 36 0A 37 -15,-2.5 -15,-2.5 -2,-0.3 2,-0.2 -0.987 23.8-126.3-139.9 131.4 60.2 6.5 -0.8 52 53 A S E -D 35 0A 9 -2,-0.3 13,-0.5 -17,-0.3 2,-0.4 -0.459 24.9-114.0 -75.9 146.1 61.6 3.0 -0.6 53 54 A Y - 0 0 0 -19,-1.8 -20,-0.4 -2,-0.2 78,-0.3 -0.653 27.8-177.2 -76.7 132.8 59.4 0.0 0.4 54 55 A V + 0 0 1 9,-2.5 2,-0.2 -2,-0.4 80,-0.2 0.565 59.3 87.6-103.8 -20.9 60.6 -1.4 3.7 55 56 A N S S- 0 0 0 8,-0.6 76,-0.1 1,-0.1 80,-0.1 -0.519 92.2-100.4 -78.1 151.2 58.0 -4.2 3.8 56 57 A S > - 0 0 15 -2,-0.2 3,-2.1 1,-0.1 -1,-0.1 -0.412 34.7-118.4 -61.6 143.8 58.6 -7.6 2.0 57 58 A P T 3 S+ 0 0 28 0, 0.0 -27,-0.2 0, 0.0 -1,-0.1 0.738 114.5 61.8 -60.0 -20.5 56.8 -7.5 -1.4 58 59 A D T 3 S+ 0 0 136 -29,-0.1 -2,-0.0 2,-0.0 -3,-0.0 0.540 89.5 80.5 -81.0 -9.6 54.7 -10.5 -0.1 59 60 A N < - 0 0 66 -3,-2.1 -4,-0.1 1,-0.1 76,-0.0 -0.884 67.2-157.3 -99.6 119.1 53.3 -8.3 2.7 60 61 A P S S+ 0 0 102 0, 0.0 2,-1.1 0, 0.0 -35,-0.4 0.607 72.1 95.7 -73.2 -9.2 50.4 -6.0 1.6 61 62 A D S S- 0 0 41 -37,-0.1 2,-0.2 -5,-0.1 -37,-0.2 -0.732 75.5-146.4 -81.1 99.4 51.1 -3.7 4.6 62 63 A L E -C 23 0A 6 -39,-2.1 -39,-2.7 -2,-1.1 2,-0.4 -0.524 14.9-162.2 -71.4 131.1 53.3 -1.1 2.8 63 64 A E E -C 22 0A 26 -41,-0.2 -9,-2.5 -2,-0.2 -8,-0.6 -0.975 9.8-173.1-122.3 135.6 56.0 0.3 5.1 64 65 A F E -C 21 0A 0 -43,-2.4 -43,-2.1 -2,-0.4 2,-0.6 -0.993 11.6-153.3-129.7 132.3 58.0 3.5 4.6 65 66 A Y E +C 20 0A 10 -13,-0.5 2,-0.3 -2,-0.4 -45,-0.2 -0.945 30.4 168.4-110.7 116.4 60.9 4.7 6.8 66 67 A L E -C 19 0A 2 -47,-3.0 -47,-2.2 -2,-0.6 2,-0.3 -0.816 30.1-150.3-129.9 165.1 61.3 8.4 6.8 67 68 A V E -C 18 0A 50 -2,-0.3 2,-0.7 -49,-0.2 -49,-0.2 -0.987 30.8-116.4-131.4 140.8 63.0 11.4 8.3 68 69 A T - 0 0 24 -51,-2.0 2,-0.3 -2,-0.3 -52,-0.0 -0.718 41.9-131.4 -77.5 118.4 61.7 15.0 8.6 69 70 A V - 0 0 68 -2,-0.7 12,-2.5 2,-0.0 2,-0.4 -0.562 27.5-177.7 -78.7 136.5 64.2 16.9 6.5 70 71 A V E +G 80 0B 92 -2,-0.3 2,-0.3 10,-0.3 10,-0.2 -0.998 12.8 158.9-132.2 130.8 65.8 20.1 7.8 71 72 A Y E -G 79 0B 119 8,-2.6 8,-3.2 -2,-0.4 2,-0.6 -0.951 43.6-111.0-147.6 167.3 68.3 22.2 5.8 72 73 A T E -G 78 0B 95 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.928 40.4-146.4-101.4 115.0 69.8 25.7 5.5 73 74 A N > - 0 0 40 4,-2.7 3,-1.7 -2,-0.6 -1,-0.0 -0.120 33.0 -88.1 -72.9-179.4 68.5 27.2 2.2 74 75 A D T 3 S+ 0 0 180 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.745 126.7 58.5 -63.2 -24.5 70.5 29.7 -0.1 75 76 A A T 3 S- 0 0 79 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.469 120.4-106.5 -83.0 -3.7 69.3 32.7 2.0 76 77 A G S < S+ 0 0 54 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.524 75.0 140.9 86.8 10.4 70.8 31.3 5.2 77 78 A E - 0 0 114 1,-0.0 -4,-2.7 0, 0.0 2,-0.6 -0.690 52.9-132.9 -86.3 136.1 67.4 30.3 6.6 78 79 A V E +G 72 0B 106 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.797 43.6 166.1 -88.7 118.1 67.0 27.0 8.5 79 80 A V E -G 71 0B 41 -8,-3.2 -8,-2.6 -2,-0.6 2,-0.2 -0.939 37.1-113.5-134.8 160.2 63.9 25.4 7.0 80 81 A K E -G 70 0B 136 -2,-0.3 -10,-0.3 -10,-0.2 -12,-0.0 -0.569 42.5-101.1 -86.3 155.3 62.0 22.1 6.9 81 82 A G - 0 0 14 -12,-2.5 -1,-0.1 -2,-0.2 -10,-0.0 -0.167 33.3-113.7 -65.9 165.2 61.6 20.2 3.6 82 83 A K S S+ 0 0 109 2,-0.1 4,-0.3 3,-0.1 -1,-0.1 0.953 101.6 20.1 -71.4 -55.2 58.3 20.5 1.7 83 84 A L S >> S+ 0 0 1 2,-0.1 4,-2.1 1,-0.1 3,-0.8 0.884 108.9 68.8 -90.2 -40.5 56.9 17.0 1.8 84 85 A S H 3> S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.834 100.5 47.0 -52.6 -43.0 58.5 15.1 4.8 85 86 A P H 3> S+ 0 0 27 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.826 111.9 52.7 -68.8 -27.1 57.0 17.1 7.7 86 87 A R H <4 S+ 0 0 114 -3,-0.8 3,-0.3 -4,-0.3 4,-0.3 0.879 110.1 47.5 -72.7 -36.3 53.5 16.8 6.0 87 88 A L H >< S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.888 108.9 55.4 -67.9 -37.7 54.0 13.0 5.8 88 89 A A H 3< S+ 0 0 28 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.737 103.3 56.5 -63.8 -25.3 55.2 13.2 9.6 89 90 A A T 3< S+ 0 0 59 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.468 82.2 113.2 -87.6 -5.7 51.8 14.9 10.5 90 91 A L < - 0 0 14 -3,-1.3 6,-0.0 -4,-0.3 -3,-0.0 -0.395 49.5-162.7 -69.7 147.0 49.7 12.1 9.0 91 92 A K > - 0 0 128 -2,-0.1 3,-2.6 4,-0.1 -83,-0.3 -0.882 37.6 -72.8-123.5 158.8 47.6 10.0 11.5 92 93 A P T 3 S+ 0 0 52 0, 0.0 -83,-0.2 0, 0.0 3,-0.1 -0.246 123.9 30.7 -52.7 135.9 46.0 6.6 11.0 93 94 A G T 3 S+ 0 0 30 -85,-3.4 -84,-0.1 1,-0.4 2,-0.1 0.055 92.2 124.6 99.5 -21.1 42.9 7.0 8.8 94 95 A D < - 0 0 66 -3,-2.6 -86,-2.8 -86,-0.1 -1,-0.4 -0.395 61.7-117.7 -72.0 148.1 44.5 9.9 6.8 95 96 A E E -A 7 0A 139 -88,-0.2 2,-0.3 -3,-0.1 -88,-0.2 -0.624 29.7-179.0 -85.9 146.6 44.8 9.6 3.0 96 97 A V E -A 6 0A 2 -90,-1.9 -90,-3.1 -2,-0.3 2,-0.4 -0.981 27.1-122.9-140.8 140.3 48.2 9.6 1.2 97 98 A Q E -AF 5 39A 41 -58,-2.8 -58,-2.4 -2,-0.3 2,-0.4 -0.757 31.0-173.0 -88.4 135.4 48.7 9.4 -2.6 98 99 A V E -AF 4 38A 0 -94,-2.7 -94,-3.2 -2,-0.4 2,-0.4 -0.988 27.0-122.6-130.2 138.0 50.8 6.4 -3.8 99 100 A V E -A 3 0A 6 -62,-1.9 -96,-0.2 -2,-0.4 -62,-0.2 -0.709 21.7-144.8 -79.4 126.5 52.2 5.6 -7.3 100 101 A S S S+ 0 0 8 -98,-2.9 -72,-3.2 -2,-0.4 2,-0.5 0.783 80.3 62.2 -64.0 -33.8 50.9 2.1 -8.2 101 102 A E S S- 0 0 100 -99,-0.3 -71,-0.1 -74,-0.2 -1,-0.1 -0.885 79.7-137.3-104.3 124.9 54.0 1.0 -10.1 102 103 A A - 0 0 25 -2,-0.5 2,-0.3 -73,-0.3 -66,-0.2 -0.292 17.6-160.8 -72.6 158.6 57.4 0.8 -8.4 103 104 A A B +E 35 0A 44 -68,-2.6 -68,-2.3 -72,-0.1 2,-0.1 -0.814 33.6 80.4-134.4 167.1 60.6 2.0 -9.9 104 105 A G - 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j 0 180C 14 28,-2.4 30,-1.9 -2,-0.4 31,-0.2 -0.894 52.9-103.9-149.3 172.0 73.5 6.8 11.8 152 153 A R S S+ 0 0 138 -2,-0.3 30,-2.9 28,-0.2 2,-0.3 0.919 100.4 13.0 -67.0 -45.8 74.4 9.9 13.9 153 154 A Y S > S- 0 0 98 28,-0.2 3,-1.6 27,-0.1 4,-0.2 -0.914 74.4-114.4-132.5 158.4 73.4 8.4 17.3 154 155 A A G > S+ 0 0 35 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.839 115.0 64.7 -59.0 -35.1 72.5 4.9 18.7 155 156 A A G 3 S+ 0 0 76 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.693 94.6 61.8 -61.6 -19.6 69.0 6.2 19.3 156 157 A D G < S+ 0 0 34 -3,-1.6 2,-2.1 1,-0.1 -1,-0.3 0.460 71.8 100.5 -86.3 -2.7 68.6 6.6 15.5 157 158 A L X + 0 0 13 -3,-1.9 3,-1.6 1,-0.2 -1,-0.1 -0.482 48.0 166.9 -84.3 68.6 69.1 2.8 14.8 158 159 A S T 3 + 0 0 10 -2,-2.1 -1,-0.2 1,-0.3 4,-0.2 0.746 68.3 44.7 -57.6 -36.1 65.3 2.3 14.4 159 160 A Y T 3> S+ 0 0 7 -3,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.193 73.1 114.4 -99.8 16.4 65.4 -1.2 12.9 160 161 A L H <> S+ 0 0 52 -3,-1.6 4,-2.3 1,-0.2 5,-0.2 0.922 78.5 52.3 -53.9 -42.5 68.0 -2.7 15.3 161 162 A P H > S+ 0 0 87 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.918 112.0 45.5 -61.4 -41.0 65.3 -5.2 16.7 162 163 A L H > S+ 0 0 34 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.901 110.8 53.2 -64.6 -42.5 64.4 -6.3 13.1 163 164 A M H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.897 110.6 48.1 -58.4 -41.2 68.1 -6.7 12.2 164 165 A Q H X S+ 0 0 103 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.894 111.7 48.6 -67.7 -42.5 68.6 -8.9 15.3 165 166 A E H X S+ 0 0 58 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.896 113.1 48.2 -64.2 -38.7 65.6 -11.0 14.4 166 167 A L H X S+ 0 0 5 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.906 108.4 54.6 -68.9 -39.7 66.9 -11.3 10.8 167 168 A E H <>S+ 0 0 86 -4,-2.6 5,-0.9 1,-0.2 4,-0.4 0.908 110.2 46.0 -59.5 -42.2 70.4 -12.3 12.1 168 169 A K H ><5S+ 0 0 178 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.943 112.0 51.6 -65.6 -46.6 68.7 -15.1 14.2 169 170 A R H 3<5S+ 0 0 121 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.869 107.1 52.9 -55.7 -43.5 66.6 -16.3 11.1 170 171 A Y T ><5S- 0 0 33 -4,-2.4 3,-1.9 -5,-0.1 -1,-0.2 0.472 98.6-140.2 -77.7 -3.0 69.7 -16.4 8.8 171 172 A E T < 5S- 0 0 178 -3,-1.3 -3,-0.1 -4,-0.4 -2,-0.1 0.724 73.3 -37.3 52.3 34.7 71.7 -18.7 11.3 172 173 A G T 3 - 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0 0 22 -2,-0.4 3,-1.7 3,-0.4 -5,-0.1 -0.987 36.9-105.1-147.0 135.9 4.6 -3.7 29.3 442 187 B A T 3 S+ 0 0 110 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.369 108.0 22.6 -60.7 130.5 3.7 -0.0 30.2 443 188 B G T 3 S+ 0 0 69 1,-0.2 -9,-0.6 -2,-0.1 2,-0.3 0.078 110.3 89.6 96.5 -19.1 5.5 2.4 27.8 444 189 B S E < S-x 434 0F 20 -3,-1.7 -3,-0.4 -11,-0.1 2,-0.3 -0.835 72.7-127.3-111.2 149.6 5.9 -0.3 25.1 445 190 B L E -x 435 0F 16 -11,-2.2 -9,-2.8 -2,-0.3 2,-0.5 -0.652 31.6-123.9 -86.2 145.6 3.7 -1.3 22.1 446 191 B T E +x 436 0F 59 -2,-0.3 2,-0.3 -11,-0.2 -9,-0.2 -0.851 65.2 29.0 -96.7 130.7 3.1 -5.0 22.0 447 192 B G S S- 0 0 23 -11,-2.1 2,-0.3 -2,-0.5 -9,-0.1 -0.940 89.9 -43.4 136.4-154.9 3.9 -7.0 18.8 448 193 B R > - 0 0 172 -2,-0.3 4,-2.0 -11,-0.1 5,-0.2 -0.864 49.1-115.2-114.4 148.3 6.4 -7.1 15.9 449 194 B I H > S+ 0 0 3 -2,-0.3 4,-2.0 2,-0.2 5,-0.2 0.890 111.3 50.6 -52.1 -52.1 7.4 -4.1 13.8 450 195 B P H > S+ 0 0 21 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.933 113.3 45.8 -57.6 -42.6 5.9 -5.2 10.4 451 196 B A H > S+ 0 0 56 1,-0.2 4,-2.2 2,-0.2 6,-0.2 0.863 113.2 50.2 -64.8 -38.1 2.4 -5.9 12.0 452 197 B L H < S+ 0 0 6 -4,-2.0 6,-2.3 2,-0.2 7,-0.4 0.772 112.2 47.6 -73.2 -27.4 2.6 -2.6 13.9 453 198 B I H >< S+ 0 0 0 -4,-2.0 3,-1.4 -5,-0.2 -2,-0.2 0.968 114.0 46.8 -71.7 -56.1 3.4 -0.7 10.7 454 199 B E H 3< S+ 0 0 128 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.815 111.2 50.8 -55.3 -39.0 0.6 -2.5 8.7 455 200 B S T 3< S- 0 0 84 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.596 107.2-125.3 -76.0 -13.8 -2.0 -1.9 11.5 456 201 B G S <> S+ 0 0 25 -3,-1.4 4,-2.1 -4,-0.3 5,-0.2 0.352 79.8 117.5 83.6 -3.8 -1.1 1.9 11.6 457 202 B E H > S+ 0 0 90 -5,-0.3 4,-2.1 -6,-0.2 5,-0.2 0.864 71.1 50.6 -61.8 -45.6 -0.5 1.5 15.4 458 203 B L H > S+ 0 0 0 -6,-2.3 4,-2.6 2,-0.2 5,-0.2 0.938 114.4 43.1 -59.2 -49.7 3.2 2.5 15.2 459 204 B E H >>S+ 0 0 27 -7,-0.4 4,-2.5 1,-0.2 5,-1.1 0.862 113.7 51.8 -64.9 -38.6 2.5 5.7 13.2 460 205 B S H <5S+ 0 0 97 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.864 112.9 45.2 -65.5 -40.5 -0.5 6.6 15.3 461 206 B T H <5S+ 0 0 65 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.926 117.9 42.9 -69.3 -47.4 1.6 6.3 18.6 462 207 B I H <5S- 0 0 12 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.835 103.3-133.7 -65.9 -35.1 4.6 8.2 17.1 463 208 B G T <5S+ 0 0 54 -4,-2.5 -3,-0.2 1,-0.3 -4,-0.1 0.650 72.6 96.1 85.5 19.4 2.3 10.8 15.5 464 209 B L S > - 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