==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-APR-06 2DKE . COMPND 2 MOLECULE: PHYCOCYANOBILIN:FERREDOXIN OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR Y.HAGIWARA,M.SUGISHIMA,Y.TAKAHASHI,K.FUKUYAMA . 241 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11291.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 72.2 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 . 54 22.4 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 . 14 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 0 0 2 1 0 0 0 0 1 0 0 0 1 0 0 0 1 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 1 1 0 0 2 0 0 3 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 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 5 A D 0 0 152 0, 0.0 2,-0.2 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0-158.0 28.1 6.8 34.3 2 6 A L - 0 0 67 23,-0.1 2,-0.1 0, 0.0 26,-0.1 -0.755 360.0-173.1-147.1 91.2 28.0 6.2 30.5 3 7 A S - 0 0 60 -2,-0.2 3,-0.4 1,-0.1 19,-0.0 -0.417 37.8-137.6 -97.3 166.7 30.5 8.4 28.7 4 8 A L S > S+ 0 0 17 1,-0.2 3,-1.1 -2,-0.1 6,-0.2 0.083 73.8 108.5 -99.7 18.0 31.6 9.5 25.2 5 9 A T T 3 S+ 0 0 114 1,-0.3 -1,-0.2 5,-0.0 0, 0.0 0.731 74.7 53.9 -71.5 -21.7 35.3 9.3 26.1 6 10 A N T 3 S+ 0 0 154 -3,-0.4 2,-0.4 4,-0.0 -1,-0.3 -0.019 82.7 127.5-102.5 32.7 35.9 6.2 24.0 7 11 A S < - 0 0 12 -3,-1.1 -3,-0.1 1,-0.1 50,-0.0 -0.738 48.3-159.6 -91.6 131.8 34.4 7.8 20.9 8 12 A S S S+ 0 0 69 -2,-0.4 4,-0.2 1,-0.1 -1,-0.1 0.547 91.0 47.4 -87.0 -7.1 36.4 7.8 17.7 9 13 A L S >> S+ 0 0 7 2,-0.1 4,-1.9 1,-0.1 3,-1.8 0.769 86.7 81.9-101.5 -33.5 34.5 10.7 16.2 10 14 A M T 34 S+ 0 0 23 1,-0.3 -2,-0.1 2,-0.2 -1,-0.1 0.806 90.4 54.5 -44.6 -38.6 34.4 13.3 19.0 11 15 A P T 34 S+ 0 0 102 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.846 118.3 33.5 -69.0 -29.2 37.9 14.5 18.2 12 16 A T T <4 S+ 0 0 84 -3,-1.8 -2,-0.2 -4,-0.2 -3,-0.1 0.582 94.5 106.2-102.2 -9.1 37.0 15.3 14.6 13 17 A L S < S- 0 0 2 -4,-1.9 5,-0.1 1,-0.1 62,-0.1 -0.377 86.3 -85.1 -71.7 147.2 33.4 16.3 15.0 14 18 A N >> - 0 0 19 1,-0.1 4,-1.8 -2,-0.1 3,-0.9 -0.224 42.3-115.7 -49.7 134.3 32.4 20.0 14.7 15 19 A P H 3> S+ 0 0 69 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.700 112.8 54.5 -48.1 -30.1 32.8 21.8 18.1 16 20 A M H 3> S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.893 108.0 49.0 -75.0 -38.4 29.1 22.5 18.5 17 21 A I H <> S+ 0 0 0 -3,-0.9 4,-2.8 2,-0.2 5,-0.2 0.868 110.2 53.2 -65.7 -36.2 28.2 18.9 18.1 18 22 A Q H X S+ 0 0 57 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.945 110.9 45.7 -61.1 -48.6 31.0 18.1 20.7 19 23 A Q H X S+ 0 0 66 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.858 113.8 48.9 -63.6 -38.9 29.4 20.6 23.1 20 24 A L H X S+ 0 0 0 -4,-2.4 4,-3.7 2,-0.2 5,-0.3 0.983 111.9 47.6 -65.2 -57.0 25.9 19.2 22.5 21 25 A A H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.892 116.0 45.3 -47.8 -48.9 27.0 15.6 23.0 22 26 A L H X S+ 0 0 99 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.884 115.4 47.1 -64.2 -39.8 28.9 16.6 26.2 23 27 A A H X S+ 0 0 19 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.865 113.1 48.9 -68.8 -38.5 25.9 18.6 27.3 24 28 A I H X S+ 0 0 0 -4,-3.7 4,-1.8 2,-0.2 -1,-0.2 0.740 111.2 51.1 -73.2 -24.4 23.5 15.8 26.5 25 29 A A H X S+ 0 0 10 -4,-1.6 4,-1.5 -5,-0.3 -2,-0.2 0.893 106.2 52.6 -79.7 -39.8 25.7 13.4 28.4 26 30 A A H X S+ 0 0 63 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.884 112.1 49.3 -60.0 -38.2 25.9 15.5 31.5 27 31 A S H >< S+ 0 0 15 -4,-1.5 3,-0.9 1,-0.2 4,-0.3 0.938 110.0 46.7 -66.9 -51.8 22.1 15.6 31.4 28 32 A W H >< S+ 0 0 6 -4,-1.8 3,-0.6 1,-0.2 5,-0.4 0.701 104.1 62.9 -68.5 -18.6 21.5 11.8 31.0 29 33 A Q H 3< S+ 0 0 58 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.759 93.2 61.2 -78.3 -21.9 23.9 10.9 33.7 30 34 A S T << S+ 0 0 88 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.628 101.1 79.0 -74.3 -11.3 21.8 12.7 36.3 31 35 A L S < S- 0 0 15 -3,-0.6 2,-1.6 -4,-0.3 153,-0.0 -0.547 98.8-106.9 -95.2 159.7 19.3 10.1 35.2 32 36 A P - 0 0 77 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 -0.457 51.1-167.2 -85.9 63.6 19.0 6.4 36.2 33 37 A L - 0 0 30 -2,-1.6 30,-0.2 -5,-0.4 28,-0.0 -0.211 14.9-178.4 -62.5 139.0 20.3 5.1 32.9 34 38 A K E -A 62 0A 113 28,-1.9 28,-2.3 -2,-0.0 2,-0.2 -0.883 38.3 -89.8-127.9 158.5 20.1 1.4 31.9 35 39 A P E -A 61 0A 102 0, 0.0 2,-0.4 0, 0.0 26,-0.3 -0.505 34.1-152.5 -75.1 138.8 21.4 -0.1 28.6 36 40 A Y - 0 0 54 24,-1.8 2,-0.8 -2,-0.2 24,-0.2 -0.865 18.6-123.0-106.7 145.8 19.0 -0.2 25.6 37 41 A Q + 0 0 150 -2,-0.4 3,-0.1 24,-0.0 24,-0.1 -0.777 31.4 173.8-100.0 106.5 19.5 -2.9 23.0 38 42 A L - 0 0 12 -2,-0.8 5,-0.1 1,-0.1 200,-0.1 -0.767 55.3 -70.9-101.9 149.9 20.1 -1.9 19.4 39 43 A P > - 0 0 25 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.109 50.3-121.1 -40.6 123.3 21.0 -4.5 16.8 40 44 A E G > S+ 0 0 161 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.816 110.0 50.7 -37.0 -49.3 24.5 -5.6 17.6 41 45 A D G > S+ 0 0 68 1,-0.2 3,-0.6 2,-0.1 -1,-0.3 0.764 103.3 60.7 -65.1 -28.2 25.9 -4.6 14.2 42 46 A L G < S+ 0 0 0 -3,-1.9 -1,-0.2 1,-0.2 3,-0.2 0.354 77.8 84.1 -86.1 5.9 24.4 -1.1 14.3 43 47 A G G < S+ 0 0 32 -3,-1.1 15,-2.0 -4,-0.4 2,-0.4 0.821 108.9 17.1 -74.5 -31.3 26.2 0.2 17.4 44 48 A Y E < S-B 57 0A 114 -3,-0.6 2,-0.4 -4,-0.3 -1,-0.3 -0.956 79.2-175.4-142.9 120.8 29.2 1.2 15.3 45 49 A V E +B 56 0A 10 11,-2.1 11,-2.1 -2,-0.4 2,-0.4 -0.965 5.8 179.1-126.2 136.3 28.8 1.4 11.5 46 50 A E E +B 55 0A 95 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.990 17.9 132.5-134.2 141.8 31.5 2.1 8.9 47 51 A G E -B 54 0A 12 7,-2.2 7,-2.3 -2,-0.4 2,-0.3 -0.928 43.9 -92.1-165.4-171.2 31.1 2.3 5.1 48 52 A R E +B 53 0A 142 177,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.908 25.5 178.4-122.7 150.3 31.9 4.2 1.9 49 53 A L E > S-B 52 0A 17 3,-2.3 3,-2.6 -2,-0.3 176,-0.1 -0.917 78.0 -15.4-152.4 120.8 30.1 6.9 0.0 50 54 A E T 3 S- 0 0 158 -2,-0.3 3,-0.1 1,-0.3 175,-0.0 0.847 129.5 -55.8 52.1 34.7 31.3 8.6 -3.1 51 55 A G T 3 S+ 0 0 56 1,-0.3 -1,-0.3 26,-0.0 2,-0.2 0.189 115.8 114.2 86.9 -16.7 34.7 7.2 -2.2 52 56 A E E < -B 49 0A 86 -3,-2.6 -3,-2.3 1,-0.1 -1,-0.3 -0.598 69.6-108.4 -92.7 151.1 34.8 8.7 1.3 53 57 A K E -B 48 0A 112 -2,-0.2 24,-2.4 -5,-0.2 2,-0.4 -0.404 31.7-166.2 -72.6 145.2 34.7 6.9 4.6 54 58 A L E +BC 47 76A 1 -7,-2.3 -7,-2.2 22,-0.2 2,-0.3 -0.998 7.4 178.7-134.2 140.9 31.5 7.2 6.8 55 59 A V E -BC 46 75A 11 20,-2.5 20,-2.2 -2,-0.4 2,-0.3 -0.991 6.8-171.3-142.1 149.2 31.1 6.2 10.4 56 60 A I E -BC 45 74A 4 -11,-2.1 -11,-2.1 -2,-0.3 2,-0.5 -0.997 7.9-161.1-141.1 143.8 28.3 6.3 12.9 57 61 A E E -BC 44 73A 12 16,-3.3 16,-2.5 -2,-0.3 2,-0.5 -0.993 9.7-167.4-126.1 120.4 28.1 5.8 16.7 58 62 A N E - C 0 72A 12 -15,-2.0 2,-0.5 -2,-0.5 14,-0.2 -0.932 1.8-170.5-109.7 130.3 24.8 5.0 18.2 59 63 A R E - C 0 71A 40 12,-2.6 12,-2.9 -2,-0.5 2,-0.4 -0.993 8.2-170.9-123.0 126.9 24.5 5.1 22.0 60 64 A C E + C 0 70A 14 -2,-0.5 -24,-1.8 -24,-0.2 2,-0.3 -0.967 11.4 159.5-128.0 135.7 21.3 3.9 23.6 61 65 A Y E -AC 35 69A 33 8,-2.0 8,-3.1 -2,-0.4 2,-0.3 -0.878 13.2-162.4-141.4 171.2 19.9 4.0 27.1 62 66 A Q E -A 34 0A 50 -28,-2.3 -28,-1.9 -2,-0.3 5,-0.2 -0.990 7.1-175.5-155.4 159.6 16.6 3.7 29.0 63 67 A T E > - C 0 66A 2 3,-2.0 3,-1.5 -2,-0.3 27,-0.1 -0.956 51.3 -92.9-148.7 159.9 14.9 4.4 32.4 64 68 A P T 3 S+ 0 0 81 0, 0.0 3,-0.1 0, 0.0 29,-0.1 0.752 130.4 47.4 -50.6 -21.1 11.4 3.6 33.7 65 69 A Q T 3 S+ 0 0 33 1,-0.2 25,-2.6 24,-0.1 2,-0.5 0.702 113.0 51.0 -91.2 -24.9 10.4 7.0 32.4 66 70 A F E < -CD 63 89A 0 -3,-1.5 -3,-2.0 23,-0.3 3,-0.2 -0.957 58.7-162.5-124.8 121.9 12.0 6.6 29.0 67 71 A R E S- 0 0 33 21,-1.3 2,-0.3 -2,-0.5 -1,-0.2 0.935 83.3 -2.8 -58.2 -52.6 11.5 3.7 26.6 68 72 A K E - D 0 88A 1 20,-1.2 20,-3.7 -6,-0.1 2,-0.6 -0.964 57.6-164.8-150.4 125.4 14.6 4.5 24.4 69 73 A M E -CD 61 87A 0 -8,-3.1 -8,-2.0 -2,-0.3 2,-0.4 -0.940 20.1-166.5-113.3 109.5 17.1 7.3 24.6 70 74 A H E -CD 60 86A 0 16,-2.9 16,-2.2 -2,-0.6 2,-0.5 -0.836 16.0-176.1-106.5 129.8 19.2 7.5 21.4 71 75 A L E -CD 59 85A 5 -12,-2.9 -12,-2.6 -2,-0.4 2,-0.5 -0.979 12.8-172.7-119.4 117.1 22.4 9.5 20.8 72 76 A E E +CD 58 84A 3 12,-4.3 12,-2.9 -2,-0.5 2,-0.4 -0.939 7.6 176.6-115.8 130.4 23.7 9.3 17.2 73 77 A L E +CD 57 83A 0 -16,-2.5 -16,-3.3 -2,-0.5 2,-0.3 -0.993 10.9 164.3-129.5 137.6 27.0 10.7 16.0 74 78 A A E -CD 56 82A 3 8,-1.8 8,-2.3 -2,-0.4 2,-0.4 -0.998 26.9-157.8-156.5 149.0 28.3 10.3 12.5 75 79 A K E -CD 55 81A 37 -20,-2.2 -20,-2.5 -2,-0.3 2,-0.5 -0.997 13.0-174.9-125.5 123.8 30.9 11.6 10.0 76 80 A V E > -C 54 0A 19 4,-2.6 3,-0.6 -2,-0.4 4,-0.2 -0.936 59.0 -36.2-125.3 109.1 30.2 11.2 6.3 77 81 A G T 3 S- 0 0 16 -24,-2.4 -22,-0.1 -2,-0.5 -1,-0.1 -0.222 98.8 -53.5 74.6-169.2 33.0 12.3 4.1 78 82 A K T 3 S+ 0 0 76 -3,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.451 134.2 35.9 -82.9 -1.5 35.2 15.3 4.9 79 83 A G S < S+ 0 0 19 -3,-0.6 -2,-0.1 1,-0.1 25,-0.1 0.627 86.4 78.9-111.3 -91.7 32.1 17.4 5.2 80 84 A L - 0 0 56 -4,-0.2 -4,-2.6 -5,-0.1 2,-0.4 0.122 49.3-179.4 -31.2 109.3 28.8 16.2 6.7 81 85 A D E -DE 75 104A 10 23,-3.8 23,-2.5 -6,-0.2 2,-0.4 -0.944 9.2-168.6-113.5 137.2 28.9 16.1 10.5 82 86 A I E -DE 74 103A 30 -8,-2.3 -8,-1.8 -2,-0.4 2,-0.4 -0.986 19.4-178.6-137.2 133.2 25.8 14.9 12.2 83 87 A L E +DE 73 102A 0 19,-2.5 19,-2.4 -2,-0.4 2,-0.4 -0.996 13.6 176.9-124.5 128.7 24.5 14.8 15.8 84 88 A H E +DE 72 101A 4 -12,-2.9 -12,-4.3 -2,-0.4 2,-0.4 -0.985 2.4 170.6-137.4 128.3 21.1 13.2 16.4 85 89 A C E +DE 71 100A 0 15,-2.5 15,-2.3 -2,-0.4 2,-0.3 -0.997 3.0 167.9-142.2 134.8 19.4 12.7 19.8 86 90 A V E -DE 70 99A 1 -16,-2.2 -16,-2.9 -2,-0.4 2,-0.6 -0.995 20.5-152.2-145.3 137.7 16.0 11.6 20.8 87 91 A M E -D 69 0A 0 11,-1.3 11,-0.4 -2,-0.3 -18,-0.3 -0.957 15.3-152.1-112.4 117.5 14.5 10.6 24.1 88 92 A F E -D 68 0A 0 -20,-3.7 -21,-1.3 -2,-0.6 -20,-1.2 -0.813 14.3-139.9 -94.9 111.9 11.6 8.1 23.8 89 93 A P E -D 66 0A 4 0, 0.0 -23,-0.3 0, 0.0 116,-0.1 -0.428 16.9-116.5 -71.6 139.2 9.1 8.4 26.7 90 94 A E > - 0 0 57 -25,-2.6 3,-3.0 1,-0.1 4,-0.3 -0.694 29.9-131.3 -77.6 107.8 7.5 5.3 28.3 91 95 A P G > S+ 0 0 3 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.638 98.9 71.9 -28.0 -41.3 3.8 5.9 27.4 92 96 A L G 3 S+ 0 0 51 1,-0.3 101,-3.4 106,-0.2 106,-0.1 0.687 99.8 47.1 -57.8 -20.5 2.7 5.2 31.0 93 97 A Y G < S- 0 0 51 -3,-3.0 98,-0.3 99,-0.2 -1,-0.3 0.512 95.2-139.1-103.4 -3.8 4.2 8.6 32.1 94 98 A G < + 0 0 9 -3,-1.5 25,-0.1 -4,-0.3 26,-0.1 0.725 43.8 155.0 53.7 31.8 2.8 10.8 29.4 95 99 A L - 0 0 8 -5,-0.3 2,-0.2 -30,-0.2 -1,-0.2 -0.418 46.3-108.0 -85.3 163.3 6.0 12.9 28.9 96 100 A P - 0 0 1 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.528 35.9-112.5 -83.7 157.3 6.9 14.7 25.7 97 101 A L E - F 0 117A 1 20,-1.5 20,-2.4 -2,-0.2 -9,-0.1 -0.835 26.2-139.5-100.1 123.7 9.7 13.3 23.6 98 102 A F E + F 0 116A 0 -2,-0.6 -11,-1.3 -11,-0.4 2,-0.2 -0.216 28.7 166.0 -68.4 164.0 12.9 15.3 23.4 99 103 A G E +EF 86 115A 11 16,-0.9 16,-2.5 -13,-0.2 2,-0.3 -0.737 9.6 164.0 177.0 132.5 14.8 15.6 20.1 100 104 A C E -EF 85 114A 0 -15,-2.3 -15,-2.5 14,-0.3 2,-0.3 -0.982 11.1-164.3-151.7 157.5 17.5 17.7 18.5 101 105 A D E -EF 84 113A 48 12,-2.6 12,-2.3 -2,-0.3 2,-0.4 -0.979 5.2-160.1-143.6 151.0 19.8 17.4 15.5 102 106 A I E -EF 83 112A 0 -19,-2.4 -19,-2.5 -2,-0.3 2,-0.4 -0.999 7.1-174.8-134.3 132.8 23.0 19.2 14.3 103 107 A V E +EF 82 111A 49 8,-2.5 7,-2.0 -2,-0.4 8,-1.9 -0.996 18.7 157.6-127.5 121.6 24.1 19.2 10.7 104 108 A A E +EF 81 109A 3 -23,-2.5 -23,-3.8 -2,-0.4 5,-0.2 -0.973 14.4 175.3-144.6 160.5 27.4 20.7 9.9 105 109 A G E > - F 0 108A 21 3,-2.2 3,-1.9 -2,-0.3 -26,-0.1 -0.701 59.3 -51.0-143.2-164.8 30.2 20.7 7.4 106 110 A P T 3 S+ 0 0 122 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.869 131.1 50.8 -42.3 -50.1 33.5 22.4 6.5 107 111 A G T 3 S- 0 0 84 1,-0.2 2,-0.1 0, 0.0 -28,-0.0 0.024 118.9 -96.9 -84.6 29.6 31.9 25.9 6.9 108 112 A G E < S-F 105 0A 23 -3,-1.9 -3,-2.2 -2,-0.1 2,-0.5 -0.434 72.8 -12.1 94.2-168.9 30.3 25.4 10.3 109 113 A V E -F 104 0A 9 -5,-0.2 -5,-0.3 1,-0.2 3,-0.1 -0.588 45.6-179.4 -78.9 122.8 26.8 24.5 11.3 110 114 A S E S+ 0 0 63 -7,-2.0 2,-0.4 -2,-0.5 -6,-0.2 0.863 72.9 13.6 -85.7 -42.4 24.1 24.5 8.6 111 115 A A E -F 103 0A 20 -8,-1.9 -8,-2.5 51,-0.1 2,-0.4 -0.996 53.3-178.7-143.1 139.3 21.2 23.5 10.8 112 116 A A E +FG 102 161A 0 49,-2.8 49,-1.7 -2,-0.4 2,-0.4 -0.970 15.8 175.5-134.3 113.2 20.6 23.2 14.6 113 117 A I E +FG 101 160A 29 -12,-2.3 -12,-2.6 -2,-0.4 2,-0.3 -0.980 3.7 165.7-125.4 134.3 17.1 21.9 15.6 114 118 A A E +FG 100 159A 0 45,-1.8 45,-2.5 -2,-0.4 2,-0.3 -0.998 8.3 149.4-146.8 142.3 15.9 21.1 19.1 115 119 A D E -F 99 0A 2 -16,-2.5 -16,-0.9 -2,-0.3 2,-0.7 -0.994 43.2-127.8-169.5 158.2 12.4 20.5 20.6 116 120 A L E -F 98 0A 4 -2,-0.3 41,-0.3 -18,-0.2 -18,-0.2 -0.961 41.7-148.6-111.8 108.1 10.2 18.9 23.2 117 121 A S E -F 97 0A 3 -20,-2.4 -20,-1.5 -2,-0.7 2,-0.8 -0.587 14.1-112.0 -87.4 142.8 7.4 17.2 21.2 118 122 A P - 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0 0 40 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.0 -0.418 34.8 -47.2 107.2 175.1 12.4 33.7 27.8 138 142 A Q - 0 0 174 -2,-0.1 2,-0.5 -3,-0.1 -4,-0.0 -0.732 53.6-125.9 -89.5 129.4 12.4 34.3 24.0 139 143 A P - 0 0 44 0, 0.0 2,-0.9 0, 0.0 -2,-0.1 -0.628 20.8-154.3 -75.9 117.3 15.3 32.7 22.0 140 144 A E + 0 0 127 -2,-0.5 2,-0.3 31,-0.0 31,-0.0 -0.791 30.7 147.3-101.1 99.9 17.0 35.4 19.9 141 145 A F - 0 0 19 -2,-0.9 3,-0.1 1,-0.1 0, 0.0 -0.936 44.8-136.6-128.2 151.6 18.8 33.9 16.9 142 146 A E S S+ 0 0 154 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.980 89.5 45.8 -72.4 -56.7 19.4 35.4 13.4 143 147 A Q S S+ 0 0 59 19,-0.4 19,-1.3 2,-0.0 2,-0.2 -0.784 78.3 130.0 -94.8 126.9 18.5 32.4 11.2 144 148 A Q + 0 0 93 -2,-0.5 17,-0.2 17,-0.2 15,-0.1 -0.853 26.2 36.3-154.4-172.6 15.3 30.4 11.9 145 149 A R + 0 0 202 -2,-0.2 14,-0.0 13,-0.1 -2,-0.0 0.208 35.8 128.9 53.3-170.2 12.0 28.8 10.9 146 150 A E + 0 0 148 1,-0.2 -1,-0.1 2,-0.0 0, 0.0 0.608 33.7 172.4 95.6 24.7 10.9 27.0 7.7 147 151 A L - 0 0 62 1,-0.1 -1,-0.2 2,-0.1 4,-0.1 -0.428 34.5-115.1 -65.0 125.7 9.5 23.9 9.4 148 152 A P > - 0 0 55 0, 0.0 3,-2.6 0, 0.0 -1,-0.1 -0.106 28.7 -95.6 -60.9 160.0 7.7 21.7 6.7 149 153 A P T 3 S+ 0 0 136 0, 0.0 3,-0.4 0, 0.0 -2,-0.1 0.546 124.5 62.5 -51.5 -13.5 3.9 21.0 6.7 150 154 A W T > S+ 0 0 50 1,-0.2 3,-1.3 2,-0.1 4,-0.1 0.240 70.8 102.2 -97.9 12.0 4.6 17.7 8.5 151 155 A G G X + 0 0 13 -3,-2.6 3,-1.2 1,-0.3 -1,-0.2 0.377 46.4 103.2 -73.6 4.7 5.9 19.8 11.3 152 156 A E G 3 S+ 0 0 91 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.809 72.1 65.4 -53.4 -30.7 2.5 19.0 12.8 153 157 A I G < S+ 0 0 9 -3,-1.3 -1,-0.3 55,-0.1 -2,-0.2 0.795 92.2 68.6 -63.8 -37.3 4.6 16.6 14.9 154 158 A F S < S- 0 0 37 -3,-1.2 -37,-0.1 -37,-0.2 -39,-0.0 -0.421 79.9-111.0 -90.6 164.7 6.6 19.1 16.8 155 159 A S > - 0 0 12 -39,-0.2 3,-0.5 -2,-0.1 -1,-0.1 -0.054 30.2-101.8 -81.2-175.6 5.7 21.6 19.5 156 160 A E T 3 S+ 0 0 100 1,-0.2 -39,-0.1 -40,-0.1 -1,-0.1 0.513 113.7 62.2 -88.2 -9.6 5.6 25.4 19.5 157 161 A Y T 3 S+ 0 0 58 -41,-0.3 -1,-0.2 2,-0.1 -43,-0.1 0.355 72.5 142.1 -97.4 6.0 8.8 26.0 21.4 158 162 A C < - 0 0 33 -3,-0.5 2,-0.7 -42,-0.1 -43,-0.2 -0.214 40.6-153.1 -51.3 126.7 10.8 24.3 18.6 159 163 A L E +G 114 0A 6 -45,-2.5 -45,-1.8 -15,-0.1 2,-0.6 -0.900 20.2 171.4-108.5 104.2 14.1 26.1 18.0 160 164 A F E +G 113 0A 39 -2,-0.7 -47,-0.2 -47,-0.2 2,-0.1 -0.692 19.4 158.3-114.5 77.4 15.2 25.6 14.3 161 165 A I E -G 112 0A 1 -49,-1.7 -49,-2.8 -2,-0.6 -17,-0.2 -0.423 43.0-145.0 -98.4 173.1 18.1 27.9 13.8 162 166 A R - 0 0 129 -19,-1.3 -19,-0.4 -51,-0.2 -51,-0.1 -0.866 43.9-117.0-133.8 88.2 21.1 28.1 11.5 163 167 A P - 0 0 7 0, 0.0 3,-0.1 0, 0.0 -19,-0.0 0.055 23.9-163.9 -31.8 125.4 23.8 29.4 13.8 164 168 A S - 0 0 40 1,-0.2 2,-0.3 -21,-0.1 3,-0.0 0.465 68.9 -20.6 -95.0 -3.5 25.0 32.8 12.6 165 169 A N S > S- 0 0 76 1,-0.1 4,-1.1 -56,-0.0 -1,-0.2 -0.966 78.4 -76.7 176.4 175.9 28.2 32.6 14.7 166 170 A V H > S+ 0 0 87 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.756 120.0 62.8 -62.5 -29.5 29.9 31.0 17.7 167 171 A T H >> S+ 0 0 81 1,-0.2 4,-0.9 2,-0.2 3,-0.6 0.988 107.3 42.1 -57.3 -60.0 28.0 33.1 20.2 168 172 A E H 3> S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.680 103.7 68.1 -62.0 -22.9 24.7 31.6 19.1 169 173 A E H 3X S+ 0 0 28 -4,-1.1 4,-1.5 1,-0.2 -1,-0.2 0.954 107.4 38.3 -62.4 -47.2 26.2 28.1 19.0 170 174 A E H < S+ 0 0 3 -4,-1.1 3,-1.1 -5,-0.2 -1,-0.2 0.939 102.2 42.2 -63.5 -51.3 10.8 13.1 34.7 188 192 A I H 3< S+ 0 0 134 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.820 117.6 46.8 -68.3 -33.4 11.2 12.4 38.4 189 193 A V T 3< S+ 0 0 81 -4,-1.6 -1,-0.3 2,-0.1 2,-0.2 0.027 87.6 120.6 -97.9 24.9 7.8 13.9 39.3 190 194 A A < - 0 0 22 -3,-1.1 -96,-0.1 -5,-0.1 -97,-0.1 -0.618 45.8-159.4 -87.9 150.0 6.0 12.1 36.6 191 195 A E - 0 0 157 -98,-0.3 2,-0.1 -2,-0.2 -2,-0.1 -0.952 28.4 -85.8-132.4 152.5 3.2 9.7 37.5 192 196 A P - 0 0 79 0, 0.0 -99,-0.2 0, 0.0 -100,-0.1 -0.307 43.4-142.6 -56.7 125.1 1.4 6.7 35.8 193 197 A L - 0 0 51 -101,-3.4 2,-0.3 1,-0.1 -101,-0.0 -0.198 34.5 -78.2 -78.4 176.7 -1.4 7.8 33.5 194 198 A S >> - 0 0 59 1,-0.1 4,-1.9 -2,-0.0 3,-1.9 -0.628 44.8-110.6 -79.8 136.6 -4.7 5.9 33.2 195 199 A E T 34 S+ 0 0 133 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.652 120.1 60.5 -40.1 -21.6 -4.4 2.8 30.9 196 200 A A T >> S+ 0 0 75 1,-0.1 4,-0.7 2,-0.1 3,-0.7 0.947 111.8 37.1 -72.7 -47.5 -6.5 4.7 28.4 197 201 A Q H X> S+ 0 0 75 -3,-1.9 4,-2.0 1,-0.2 3,-0.5 0.850 101.0 70.2 -73.3 -38.4 -3.9 7.5 28.2 198 202 A T H 3< S+ 0 0 13 -4,-1.9 -1,-0.2 1,-0.3 -106,-0.2 0.369 107.1 46.2 -63.7 12.0 -0.8 5.3 28.4 199 203 A L H <4 S+ 0 0 100 -3,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.601 105.2 53.9-120.4 -33.6 -2.0 4.2 24.9 200 204 A E H S+ 0 0 68 -84,-0.3 4,-3.3 3,-0.1 -2,-0.2 0.699 109.2 48.8-108.7 -41.6 -0.2 6.6 19.8 204 208 A G H X S+ 0 0 6 -4,-1.3 4,-2.7 -85,-0.6 -2,-0.2 0.948 115.0 41.7 -65.6 -52.8 1.8 9.9 19.7 205 209 A Q H X S+ 0 0 11 -4,-1.4 4,-2.8 -86,-0.3 5,-0.3 0.948 117.4 50.7 -59.8 -47.7 5.2 8.3 20.0 206 210 A I H > S+ 0 0 91 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.950 114.5 42.5 -51.7 -55.3 4.0 5.6 17.6 207 211 A H H X S+ 0 0 38 -4,-3.3 4,-1.9 1,-0.2 -1,-0.2 0.795 112.8 56.4 -61.7 -32.5 2.8 8.3 15.1 208 212 A Y H X S+ 0 0 11 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.951 108.9 42.8 -64.8 -54.3 6.0 10.3 15.8 209 213 A C H X S+ 0 0 3 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.906 114.4 51.8 -60.1 -45.2 8.4 7.6 14.8 210 214 A Q H X S+ 0 0 102 -4,-2.2 4,-0.5 -5,-0.3 -1,-0.2 0.871 112.7 45.3 -60.6 -39.9 6.3 6.6 11.8 211 215 A Q H >X S+ 0 0 46 -4,-1.9 3,-1.0 2,-0.2 4,-0.7 0.935 116.6 43.8 -69.3 -47.6 6.2 10.2 10.5 212 216 A Q H >X S+ 0 0 13 -4,-2.7 4,-2.9 1,-0.3 3,-0.8 0.866 106.7 63.0 -63.2 -37.1 9.9 10.8 11.1 213 217 A Q H 3< S+ 0 0 34 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.709 109.1 41.3 -60.5 -22.9 10.6 7.4 9.5 214 218 A K H << S+ 0 0 121 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.510 125.9 29.0-106.0 -6.1 9.1 8.7 6.3 215 219 A N H << S+ 0 0 62 -3,-0.8 2,-0.3 -4,-0.7 -2,-0.2 0.559 83.4 111.3-127.7 -17.3 10.6 12.2 6.1 216 220 A D >< - 0 0 25 -4,-2.9 3,-1.0 -5,-0.2 4,-0.2 -0.472 57.5-150.1 -62.9 122.9 13.9 12.0 8.0 217 221 A K T 3> S+ 0 0 129 -2,-0.3 4,-0.8 1,-0.2 -1,-0.1 0.277 77.9 94.7 -84.7 13.1 16.6 12.4 5.3 218 222 A T H 3> S+ 0 0 26 1,-0.2 4,-2.0 2,-0.1 -1,-0.2 0.867 80.0 67.3 -65.2 -33.6 19.2 10.3 7.0 219 223 A R H <> S+ 0 0 40 -3,-1.0 4,-2.5 1,-0.2 5,-0.3 0.916 89.3 54.5 -50.7 -63.4 17.7 7.6 4.7 220 224 A R H > S+ 0 0 139 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.862 111.4 47.7 -43.7 -46.3 18.7 8.8 1.2 221 225 A V H >X S+ 0 0 38 -4,-0.8 4,-1.9 -3,-0.2 3,-0.9 0.966 110.4 51.1 -60.4 -53.3 22.4 8.9 2.3 222 226 A L H 3X>S+ 0 0 4 -4,-2.0 4,-3.2 1,-0.3 5,-0.6 0.819 108.2 54.1 -53.6 -35.7 22.2 5.4 3.9 223 227 A E H 3X5S+ 0 0 64 -4,-2.5 4,-0.6 3,-0.2 -1,-0.3 0.800 108.2 48.2 -69.5 -32.7 20.7 4.1 0.7 224 228 A K H <<5S+ 0 0 113 -4,-1.4 -174,-0.2 -3,-0.9 -2,-0.2 0.784 119.3 39.4 -79.4 -27.5 23.6 5.5 -1.4 225 229 A A H <5S+ 0 0 24 -4,-1.9 -177,-0.3 -5,-0.1 -2,-0.2 0.912 143.6 0.2 -85.9 -46.5 26.1 4.0 1.0 226 230 A F H <5S- 0 0 59 -4,-3.2 4,-0.4 -5,-0.2 -3,-0.2 0.402 103.1-117.4-125.2 -1.1 24.4 0.7 1.8 227 231 A G X< - 0 0 16 -4,-0.6 4,-2.4 -5,-0.6 3,-0.3 0.006 39.9 -53.7 88.6 166.4 21.2 0.6 -0.2 228 232 A E H > S+ 0 0 138 -5,-0.2 4,-2.7 1,-0.2 5,-0.2 0.857 125.8 48.2 -46.3 -58.5 17.5 0.5 0.3 229 233 A A H > S+ 0 0 83 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.843 115.2 44.9 -61.2 -34.7 17.2 -2.6 2.5 230 234 A W H > S+ 0 0 56 -4,-0.4 4,-2.1 -3,-0.3 -1,-0.2 0.927 113.4 50.4 -74.9 -41.6 19.9 -1.6 4.9 231 235 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.899 110.1 50.8 -60.0 -44.7 18.6 2.0 5.1 232 236 A E H X S+ 0 0 80 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.918 109.9 48.7 -60.8 -46.7 15.1 0.7 5.9 233 237 A R H X S+ 0 0 82 -4,-1.7 4,-0.6 -5,-0.2 5,-0.3 0.881 113.4 48.4 -63.2 -36.4 16.3 -1.5 8.7 234 238 A Y H >X>S+ 0 0 0 -4,-2.1 4,-2.9 3,-0.2 5,-1.5 0.924 110.0 50.8 -69.7 -45.6 18.3 1.4 10.2 235 239 A M H 3<>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 -2,-0.2 0.913 119.3 34.6 -57.0 -49.6 15.4 3.9 10.0 236 240 A S H 3<5S+ 0 0 26 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.395 127.6 37.7 -91.0 1.6 12.8 1.7 11.7 237 241 A Q H <<5S+ 0 0 88 -4,-0.6 4,-0.2 -3,-0.5 -3,-0.2 0.643 130.3 19.5-118.4 -33.3 15.2 -0.0 14.1 238 242 A V T <5S+ 0 0 0 -4,-2.9 3,-0.3 -5,-0.3 -3,-0.2 0.867 127.2 31.3-104.7 -60.8 17.6 2.7 15.1 239 243 A L T