==== 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 OXIDOREDUCTASE 03-JUN-10 3NB9 . COMPND 2 MOLECULE: PHYCOCYANOBILIN:FERREDOXIN OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR D.D.GAE . 242 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11916.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 71.9 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 . 54 22.3 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 . 2 0.8 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 . 1 0.4 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 . 23 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 31.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.7 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 1 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 1 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 . 1 1 1 1 0 0 1 1 1 1 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 1 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 6 A L 0 0 38 0, 0.0 2,-0.8 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 -18.2 -20.2 -34.2 26.9 2 7 A S > - 0 0 70 1,-0.2 3,-0.5 26,-0.1 19,-0.0 -0.741 360.0-165.0 -63.3 115.6 -21.0 -34.9 30.5 3 8 A L G > + 0 0 15 -2,-0.8 3,-1.3 1,-0.2 -1,-0.2 0.208 64.7 103.9 -90.0 12.0 -17.4 -34.9 31.4 4 9 A T G 3 S+ 0 0 133 1,-0.3 -1,-0.2 5,-0.1 -2,-0.0 0.826 79.1 48.5 -63.8 -30.2 -18.6 -36.5 34.7 5 10 A N G < S+ 0 0 91 -3,-0.5 2,-0.4 4,-0.0 -1,-0.3 0.353 85.0 121.4 -89.3 2.7 -17.4 -39.9 33.4 6 11 A S < - 0 0 9 -3,-1.3 -3,-0.1 1,-0.2 50,-0.0 -0.586 47.3-163.6 -71.8 125.7 -13.9 -38.5 32.4 7 12 A S S S+ 0 0 72 -2,-0.4 4,-0.2 1,-0.2 -1,-0.2 0.838 91.6 44.3 -69.1 -35.1 -10.9 -40.2 34.2 8 13 A L S > S+ 0 0 13 1,-0.2 3,-2.3 2,-0.1 4,-0.4 0.874 93.5 77.9 -79.5 -39.1 -8.6 -37.3 33.2 9 14 A M G > S+ 0 0 27 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 0.832 89.4 53.0 -45.5 -50.3 -10.8 -34.3 34.0 10 15 A P G 3 S+ 0 0 97 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.737 113.0 45.9 -63.4 -12.4 -10.4 -34.2 37.8 11 16 A T G < S+ 0 0 74 -3,-2.3 2,-0.2 -4,-0.2 -2,-0.2 0.270 91.6 106.7-111.1 2.6 -6.6 -34.2 37.4 12 17 A L S < S- 0 0 9 -3,-1.7 5,-0.1 -4,-0.4 62,-0.1 -0.572 83.5 -83.1 -88.5 155.0 -6.2 -31.6 34.7 13 18 A N > - 0 0 19 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.162 45.1-117.5 -43.4 139.7 -5.0 -28.0 35.0 14 19 A P H > S+ 0 0 82 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.807 113.3 51.9 -59.5 -37.7 -7.9 -25.7 36.2 15 20 A M H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.932 110.2 50.4 -62.7 -44.8 -8.0 -23.6 33.1 16 21 A I H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.924 109.0 52.0 -55.5 -47.1 -8.2 -26.7 31.0 17 22 A Q H X S+ 0 0 57 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.923 110.7 46.9 -57.1 -45.7 -11.0 -28.0 33.1 18 23 A Q H X S+ 0 0 118 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.883 112.5 50.1 -67.0 -33.6 -13.0 -24.7 32.7 19 24 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.920 109.4 50.6 -67.6 -40.7 -12.4 -24.7 29.0 20 25 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.941 112.4 48.1 -64.4 -43.5 -13.6 -28.4 28.6 21 26 A L H X S+ 0 0 97 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.880 111.0 50.0 -62.7 -41.2 -16.7 -27.5 30.5 22 27 A A H X S+ 0 0 21 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.867 112.6 46.4 -62.2 -40.9 -17.3 -24.4 28.4 23 28 A I H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.947 113.3 48.6 -69.9 -49.2 -16.9 -26.3 25.2 24 29 A A H X S+ 0 0 5 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.913 111.7 51.3 -53.3 -43.7 -19.2 -29.2 26.4 25 30 A A H < S+ 0 0 48 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.870 107.6 52.4 -61.5 -37.6 -21.8 -26.6 27.6 26 31 A S H < S+ 0 0 32 -4,-1.8 3,-0.2 1,-0.2 -1,-0.2 0.877 117.9 37.0 -64.4 -39.4 -21.7 -25.0 24.2 27 32 A W H >< S+ 0 0 0 -4,-1.9 3,-2.0 1,-0.2 -2,-0.2 0.699 91.7 92.2 -83.6 -20.3 -22.4 -28.3 22.4 28 33 A Q T 3< S+ 0 0 129 -4,-1.7 -1,-0.2 1,-0.3 4,-0.2 0.732 92.5 34.9 -59.5 -34.5 -24.8 -29.9 24.9 29 34 A S T 3 S+ 0 0 113 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.217 92.4 111.1-103.7 9.7 -28.1 -28.8 23.4 30 35 A L S < S- 0 0 44 -3,-2.0 2,-2.4 1,-0.1 -3,-0.0 -0.353 90.1 -93.6 -75.2 165.6 -27.1 -29.0 19.7 31 36 A P + 0 0 85 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.498 67.4 179.9 -81.3 73.3 -28.7 -31.6 17.5 32 37 A L + 0 0 43 -2,-2.4 30,-0.2 -5,-0.2 28,-0.0 -0.458 22.4 176.9 -79.7 145.7 -25.7 -33.9 18.2 33 38 A K E -A 61 0A 140 28,-1.9 28,-2.1 -2,-0.2 2,-0.0 -0.966 40.2 -95.0-133.1 159.5 -24.9 -37.3 16.9 34 39 A P E -A 60 0A 106 0, 0.0 2,-0.5 0, 0.0 26,-0.3 -0.358 29.3-148.5 -69.0 151.8 -21.8 -39.3 17.6 35 40 A Y - 0 0 55 24,-2.0 2,-0.7 33,-0.1 24,-0.1 -0.990 15.5-135.5-116.7 119.0 -19.0 -39.2 15.1 36 41 A Q - 0 0 140 -2,-0.5 3,-0.1 4,-0.0 24,-0.1 -0.651 17.3-150.4 -78.6 114.3 -17.1 -42.4 14.9 37 42 A L > - 0 0 5 -2,-0.7 3,-2.1 4,-0.4 200,-0.1 -0.250 48.1 -61.7 -67.7 166.7 -13.3 -41.7 14.8 38 43 A P G > S+ 0 0 37 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 -0.296 130.7 6.4 -52.0 140.7 -11.1 -44.3 13.0 39 44 A E G 3 S- 0 0 161 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.730 124.9 -81.5 54.2 23.4 -11.4 -47.7 14.8 40 45 A D G < - 0 0 101 -3,-2.1 -1,-0.3 1,-0.2 -4,-0.0 0.886 69.0-158.3 49.3 46.1 -14.1 -46.0 16.9 41 46 A L < + 0 0 36 -3,-1.8 -4,-0.4 1,-0.1 -1,-0.2 -0.275 33.0 146.6 -60.9 137.3 -11.4 -44.5 19.1 42 47 A G + 0 0 31 1,-0.5 15,-1.3 13,-0.1 2,-0.3 0.305 65.7 10.1-125.0-102.8 -12.3 -43.4 22.6 43 48 A Y E +B 56 0A 111 13,-0.2 -1,-0.5 11,-0.0 2,-0.3 -0.607 68.8 175.9 -84.2 138.6 -9.6 -43.7 25.3 44 49 A V E +B 55 0A 23 11,-2.4 11,-2.9 -2,-0.3 2,-0.3 -0.994 6.9 179.3-144.9 145.8 -6.1 -44.5 24.3 45 50 A E E +B 54 0A 105 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.994 5.4 169.5-143.9 149.0 -2.8 -44.8 26.1 46 51 A G E -B 53 0A 11 7,-2.2 7,-2.7 -2,-0.3 2,-0.3 -0.995 11.5-175.1-157.6 155.5 0.7 -45.6 25.2 47 52 A R + 0 0 133 -2,-0.3 177,-0.2 5,-0.2 5,-0.1 -0.992 7.8 167.5-147.1 144.3 4.3 -45.7 26.3 48 53 A L S S- 0 0 92 175,-0.5 176,-0.1 3,-0.5 175,-0.1 0.244 76.7 -28.2-116.8-108.8 7.6 -46.5 24.7 49 54 A E S S+ 0 0 194 174,-0.4 175,-0.1 -2,-0.1 3,-0.1 0.527 127.0 20.6 -96.1 -1.4 10.9 -45.6 26.5 50 55 A G S S- 0 0 41 173,-0.5 2,-0.1 1,-0.4 174,-0.0 0.107 106.8 -4.0-130.1-126.0 9.7 -42.6 28.5 51 56 A E - 0 0 122 1,-0.1 -3,-0.5 -4,-0.1 -1,-0.4 -0.377 64.9-114.0 -80.5 155.4 6.5 -41.1 29.8 52 57 A K - 0 0 63 -5,-0.1 24,-2.9 -2,-0.1 2,-0.5 -0.701 21.1-148.2 -88.9 142.6 3.0 -42.5 29.1 53 58 A L E -BC 46 75A 2 -7,-2.7 -7,-2.2 -2,-0.3 2,-0.4 -0.945 12.5-171.4-108.7 129.6 0.5 -40.5 27.1 54 59 A V E -BC 45 74A 10 20,-2.7 20,-2.1 -2,-0.5 2,-0.4 -0.971 4.6-176.8-120.5 138.1 -3.2 -40.8 27.8 55 60 A I E -BC 44 73A 4 -11,-2.9 -11,-2.4 -2,-0.4 2,-0.5 -0.992 15.4-159.6-137.1 134.7 -5.9 -39.3 25.6 56 61 A E E -BC 43 72A 13 16,-2.8 16,-2.0 -2,-0.4 2,-0.5 -0.966 17.5-160.0-109.8 121.5 -9.7 -39.2 25.9 57 62 A N E + C 0 71A 15 -15,-1.3 2,-0.4 -2,-0.5 14,-0.2 -0.895 14.4 177.1-102.2 133.6 -11.4 -38.5 22.6 58 63 A R E + C 0 70A 39 12,-2.4 12,-2.8 -2,-0.5 2,-0.4 -0.992 10.6 174.4-125.8 137.5 -15.0 -37.2 22.3 59 64 A C E + C 0 69A 13 -2,-0.4 -24,-2.0 10,-0.2 2,-0.2 -0.981 3.4 164.8-151.1 131.5 -16.3 -36.5 18.8 60 65 A Y E -AC 34 68A 37 8,-2.2 8,-2.8 -2,-0.4 2,-0.3 -0.785 16.2-150.5-131.3 176.1 -19.8 -35.5 17.6 61 66 A Q E -A 33 0A 72 -28,-2.1 -28,-1.9 -2,-0.2 5,-0.2 -0.989 9.3-178.6-147.0 158.8 -21.4 -34.1 14.4 62 67 A T - 0 0 8 3,-2.4 3,-0.2 -2,-0.3 -30,-0.1 -0.863 50.3 -89.9-140.8 177.9 -24.4 -31.9 13.5 63 68 A P S S+ 0 0 75 0, 0.0 3,-0.1 0, 0.0 -31,-0.0 0.837 129.3 38.6 -64.7 -22.6 -25.8 -30.7 10.2 64 69 A Q S S+ 0 0 40 1,-0.2 25,-3.0 24,-0.1 2,-0.6 0.658 115.4 56.3 -96.1 -22.9 -23.6 -27.6 10.3 65 70 A F E - D 0 88A 2 23,-0.3 -3,-2.4 -3,-0.2 -1,-0.2 -0.934 60.7-164.8-122.2 109.9 -20.5 -29.3 11.8 66 71 A R E S+ 0 0 24 21,-1.0 2,-0.3 -2,-0.6 -1,-0.1 0.849 82.0 1.9 -54.4 -41.4 -18.9 -32.2 10.1 67 72 A K E - D 0 87A 0 20,-1.6 20,-3.3 -6,-0.1 2,-0.5 -0.961 58.3-166.2-156.5 128.8 -16.9 -33.2 13.1 68 73 A M E -CD 60 86A 0 -8,-2.8 -8,-2.2 -2,-0.3 2,-0.5 -0.935 21.5-173.9-124.4 105.3 -16.7 -31.7 16.6 69 74 A H E +CD 59 85A 0 16,-2.9 16,-1.7 -2,-0.5 2,-0.4 -0.872 14.3 179.4-115.5 127.0 -13.6 -33.1 18.3 70 75 A L E -CD 58 84A 0 -12,-2.8 -12,-2.4 -2,-0.5 2,-0.4 -0.994 9.1-176.7-125.6 118.9 -12.6 -32.6 22.0 71 76 A E E -CD 57 83A 14 12,-3.1 12,-2.6 -2,-0.4 2,-0.4 -0.966 9.5-170.3-113.5 137.2 -9.4 -34.3 23.2 72 77 A L E +CD 56 82A 0 -16,-2.0 -16,-2.8 -2,-0.4 2,-0.3 -0.978 19.4 173.8-114.5 136.3 -8.1 -34.2 26.8 73 78 A A E -CD 55 81A 8 8,-2.8 8,-2.6 -2,-0.4 2,-0.4 -0.980 20.7-165.6-143.5 157.5 -4.6 -35.6 27.3 74 79 A K E -CD 54 80A 35 -20,-2.1 -20,-2.7 -2,-0.3 2,-0.6 -0.991 9.9-155.4-137.9 134.1 -1.9 -36.0 29.9 75 80 A V E >> -CD 53 79A 26 4,-2.8 3,-1.3 -2,-0.4 4,-1.1 -0.953 67.8 -56.8-103.9 118.3 1.8 -37.0 29.5 76 81 A G T 34 S- 0 0 21 -24,-2.9 3,-0.1 -2,-0.6 -22,-0.1 -0.185 98.5 -48.3 46.4-135.1 2.9 -38.5 32.8 77 82 A K T 34 S+ 0 0 193 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.356 132.4 66.3-103.4 1.0 2.4 -36.2 35.7 78 83 A G T <4 S+ 0 0 38 -3,-1.3 2,-0.4 1,-0.2 -2,-0.2 0.446 92.1 48.0-110.3 -1.0 4.0 -33.2 33.9 79 84 A L E < -D 75 0A 44 -4,-1.1 -4,-2.8 25,-0.2 2,-0.3 -0.910 49.5-175.2-157.4 117.9 1.9 -32.2 31.0 80 85 A D E -DE 74 103A 15 23,-2.6 23,-2.7 -2,-0.4 2,-0.4 -0.904 11.6-172.9-114.3 141.8 -1.8 -31.6 30.4 81 86 A I E -DE 73 102A 27 -8,-2.6 -8,-2.8 -2,-0.3 2,-0.4 -0.991 13.8-170.0-136.2 139.4 -3.4 -30.8 27.0 82 87 A L E -DE 72 101A 0 19,-2.3 19,-2.6 -2,-0.4 2,-0.4 -1.000 13.7-179.9-122.5 132.9 -6.8 -29.8 25.7 83 88 A Q E +DE 71 100A 11 -12,-2.6 -12,-3.1 -2,-0.4 2,-0.3 -0.993 4.1 169.0-127.7 139.9 -7.5 -29.9 21.9 84 89 A C E +DE 70 99A 0 15,-2.3 15,-2.5 -2,-0.4 2,-0.4 -0.967 7.0 170.9-148.5 136.8 -10.7 -29.0 20.1 85 90 A V E -DE 69 98A 2 -16,-1.7 -16,-2.9 -2,-0.3 2,-0.7 -0.990 17.6-158.2-137.5 138.4 -11.7 -28.4 16.5 86 91 A M E -DE 68 97A 0 11,-2.5 11,-0.8 -2,-0.4 -18,-0.2 -0.962 18.6-155.9-108.1 111.0 -15.2 -27.9 15.1 87 92 A F E -D 67 0A 0 -20,-3.3 -20,-1.6 -2,-0.7 -21,-1.0 -0.799 16.8-133.1 -90.6 120.8 -14.8 -28.8 11.4 88 93 A P E -D 65 0A 3 0, 0.0 -23,-0.3 0, 0.0 -24,-0.1 -0.338 14.0-112.6 -74.9 151.0 -17.5 -27.1 9.5 89 94 A E >>> - 0 0 64 -25,-3.0 3,-2.1 1,-0.1 4,-0.6 -0.773 31.9-137.0 -74.7 120.4 -19.8 -28.7 6.8 90 95 A P G >45S+ 0 0 8 0, 0.0 3,-1.1 0, 0.0 110,-0.2 0.791 96.0 72.9 -58.0 -29.6 -18.5 -26.8 3.8 91 96 A L G 345S+ 0 0 71 1,-0.3 101,-2.2 2,-0.1 106,-0.1 0.813 100.7 45.1 -47.4 -35.8 -22.0 -26.2 2.4 92 97 A Y G <45S- 0 0 50 -3,-2.1 -1,-0.3 99,-0.2 98,-0.1 0.645 99.7-138.0 -94.2 -7.3 -22.6 -23.6 5.2 93 98 A G T <<5 + 0 0 6 -3,-1.1 25,-0.2 -4,-0.6 26,-0.1 0.768 42.9 158.9 62.8 27.3 -19.3 -21.9 4.8 94 99 A L < - 0 0 6 -5,-0.5 -1,-0.2 -30,-0.2 -2,-0.1 -0.502 40.1-112.0 -80.0 151.7 -18.6 -21.5 8.5 95 100 A P - 0 0 0 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.128 35.9 -93.8 -71.9 179.8 -15.0 -20.9 9.8 96 101 A L E - F 0 116A 0 20,-2.6 20,-2.6 -9,-0.1 2,-0.4 -0.838 29.9-152.3 -98.4 111.5 -13.1 -23.4 11.8 97 102 A F E +EF 86 115A 0 -11,-0.8 -11,-2.5 -2,-0.7 2,-0.3 -0.641 27.7 169.1 -74.7 130.4 -13.3 -23.1 15.6 98 103 A G E +EF 85 114A 8 16,-2.4 16,-2.3 -2,-0.4 2,-0.3 -0.998 16.2 178.2-141.9 152.9 -10.1 -24.4 17.2 99 104 A C E -EF 84 113A 6 -15,-2.5 -15,-2.3 -2,-0.3 2,-0.4 -0.994 3.3-178.5-146.9 143.0 -8.4 -24.4 20.6 100 105 A D E -EF 83 112A 36 12,-2.1 12,-2.8 -2,-0.3 2,-0.4 -0.977 5.0-177.7-144.0 130.1 -5.2 -25.9 22.0 101 106 A I E -EF 82 111A 0 -19,-2.6 -19,-2.3 -2,-0.4 2,-0.4 -0.994 2.2-175.3-129.4 129.6 -4.1 -25.6 25.6 102 107 A V E +EF 81 110A 30 8,-2.5 7,-2.2 -2,-0.4 8,-1.9 -0.999 11.3 173.1-126.5 130.0 -0.8 -27.0 27.0 103 108 A A E -EF 80 108A 1 -23,-2.7 -23,-2.6 -2,-0.4 5,-0.3 -0.986 10.1-178.8-136.5 146.2 0.0 -26.8 30.7 104 109 A G E > - 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0 0 27 -4,-0.9 -96,-0.1 -5,-0.2 -97,-0.0 -0.640 55.9-151.2 -81.6 137.3 -26.1 -19.6 7.6 190 195 A E - 0 0 140 -2,-0.3 2,-0.1 -98,-0.1 -2,-0.1 -0.605 33.2 -87.0-100.9 158.3 -27.6 -20.9 4.2 191 196 A P - 0 0 82 0, 0.0 -99,-0.2 0, 0.0 2,-0.1 -0.449 54.9-139.9 -56.1 131.5 -26.5 -23.8 1.9 192 197 A L - 0 0 48 -101,-2.2 -99,-0.1 1,-0.2 -100,-0.0 -0.467 22.9 -80.3 -91.0 174.9 -24.0 -22.2 -0.4 193 198 A S > - 0 0 56 -2,-0.1 4,-3.0 1,-0.1 5,-0.2 -0.141 42.9-107.6 -65.3 161.8 -23.5 -22.6 -4.1 194 199 A E H > S+ 0 0 182 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.898 121.8 48.1 -62.3 -34.7 -21.5 -25.7 -5.4 195 200 A A H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 113.5 47.4 -73.0 -38.1 -18.5 -23.4 -6.3 196 201 A Q H > S+ 0 0 90 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.907 109.3 53.4 -69.2 -40.1 -18.6 -21.8 -2.9 197 202 A T H X S+ 0 0 14 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.928 110.1 48.9 -57.7 -42.7 -18.9 -25.2 -1.2 198 203 A L H X S+ 0 0 79 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.921 107.7 53.6 -63.3 -47.1 -15.8 -26.2 -3.1 199 204 A E H X S+ 0 0 51 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.925 112.3 45.2 -54.4 -50.4 -13.9 -23.0 -2.1 200 205 A H H X S+ 0 0 14 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.856 110.0 53.9 -57.1 -41.9 -14.7 -23.7 1.6 201 206 A R H X S+ 0 0 95 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.920 107.6 51.4 -58.1 -46.0 -13.8 -27.4 1.3 202 207 A Q H X S+ 0 0 107 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.898 108.4 52.0 -57.0 -39.1 -10.4 -26.3 -0.1 203 208 A G H X S+ 0 0 17 -4,-1.7 4,-2.0 -85,-0.5 -1,-0.2 0.881 110.0 48.2 -65.5 -41.4 -9.9 -24.0 2.9 204 209 A Q H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.904 110.2 51.1 -66.5 -41.5 -10.6 -26.7 5.3 205 210 A I H X S+ 0 0 37 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.946 110.8 49.7 -58.2 -47.9 -8.2 -29.2 3.5 206 211 A H H X S+ 0 0 74 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.880 108.0 53.8 -57.2 -44.6 -5.4 -26.5 3.6 207 212 A Y H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.927 111.3 45.5 -56.0 -47.0 -6.1 -26.0 7.4 208 213 A C H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.918 111.2 51.9 -65.5 -42.3 -5.6 -29.7 8.1 209 214 A Q H < S+ 0 0 100 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.917 113.5 44.7 -61.3 -40.7 -2.5 -30.0 5.9 210 215 A Q H >< S+ 0 0 21 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.910 107.5 56.6 -71.1 -41.7 -0.9 -27.0 7.7 211 216 A Q H >< S+ 0 0 18 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.821 97.7 64.9 -57.7 -29.7 -1.9 -28.2 11.2 212 217 A Q T 3< S+ 0 0 33 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.665 88.5 69.4 -68.4 -15.5 0.0 -31.5 10.4 213 218 A K T < + 0 0 123 -3,-2.0 2,-1.3 -4,-0.3 -1,-0.3 0.432 68.9 115.0 -79.7 3.1 3.3 -29.4 10.2 214 219 A N <> - 0 0 21 -3,-1.6 4,-2.3 1,-0.2 3,-0.3 -0.569 41.3-179.9 -81.6 96.7 3.1 -28.9 14.0 215 220 A D H > S+ 0 0 114 -2,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.665 75.3 66.3 -71.9 -14.7 6.2 -30.8 15.2 216 221 A K H > S+ 0 0 170 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.934 108.3 38.4 -74.1 -45.0 5.4 -29.9 18.9 217 222 A T H > S+ 0 0 35 -3,-0.3 4,-2.2 2,-0.2 3,-0.2 0.944 115.9 53.9 -62.8 -46.4 2.3 -32.0 18.8 218 223 A R H X S+ 0 0 38 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.889 104.6 52.9 -60.2 -39.9 4.0 -34.7 16.6 219 224 A R H X S+ 0 0 159 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.879 107.2 52.5 -65.9 -40.3 7.0 -35.1 19.0 220 225 A V H X S+ 0 0 42 -4,-1.3 4,-1.1 -3,-0.2 -1,-0.2 0.957 113.5 43.8 -59.6 -44.5 4.6 -35.8 22.0 221 226 A L H X>S+ 0 0 10 -4,-2.2 4,-2.5 1,-0.2 5,-0.5 0.920 113.5 51.0 -67.7 -41.5 2.8 -38.4 20.1 222 227 A E H X5S+ 0 0 48 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.859 104.3 56.8 -63.4 -37.3 6.0 -40.0 18.7 223 228 A K H <5S+ 0 0 122 -4,-2.3 -175,-0.5 1,-0.2 -173,-0.5 0.797 118.6 33.0 -66.7 -27.1 7.6 -40.3 22.2 224 229 A A H <5S+ 0 0 3 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.776 139.6 10.9 -96.8 -30.2 4.7 -42.3 23.4 225 230 A F H <5S- 0 0 38 -4,-2.5 4,-0.4 -5,-0.2 -3,-0.2 0.501 101.0-112.3-128.2 -14.5 3.6 -44.3 20.3 226 231 A G X< - 0 0 9 -4,-1.6 4,-2.4 -5,-0.5 5,-0.2 -0.135 39.3 -65.9 92.7 166.2 6.2 -43.9 17.6 227 232 A E H > S+ 0 0 132 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.902 126.4 47.4 -59.6 -49.4 6.4 -42.3 14.2 228 233 A A H > S+ 0 0 83 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.913 113.7 47.6 -62.0 -45.8 3.9 -44.4 12.3 229 234 A W H > S+ 0 0 66 -4,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.922 112.7 49.5 -59.9 -43.4 1.2 -44.2 15.0 230 235 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.885 110.3 50.9 -67.6 -37.4 1.7 -40.4 15.3 231 236 A E H X S+ 0 0 83 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.911 112.8 45.1 -62.2 -44.8 1.5 -40.1 11.5 232 237 A R H X>S+ 0 0 77 -4,-2.5 4,-2.4 2,-0.2 5,-0.7 0.917 114.3 50.0 -64.0 -41.2 -1.8 -42.0 11.5 233 238 A Y H X>S+ 0 0 6 -4,-2.9 5,-2.7 3,-0.2 4,-1.7 0.941 114.4 43.1 -65.2 -45.5 -3.1 -40.1 14.5 234 239 A M H <>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 -1,-0.2 0.899 122.8 36.6 -69.5 -37.8 -2.3 -36.6 13.0 235 240 A S H <5S+ 0 0 25 -4,-2.3 6,-0.6 -5,-0.2 -1,-0.2 0.697 131.6 25.3 -90.5 -21.4 -3.6 -37.4 9.5 236 241 A Q H <5S+ 0 0 87 -4,-2.4 -3,-0.2 -5,-0.2 4,-0.2 0.707 131.1 28.5-114.7 -30.3 -6.6 -39.6 10.3 237 242 A V T <