==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-SEP-07 2VCK . COMPND 2 MOLECULE: CYANOBACTERIAL PHYCOERYTHROBILIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PROCHLOROCOCCUS PHAGE P-SSM2; . AUTHOR T.DAMMEYER,E.HOFMANN,N.FRANKENBERG-DINKEL . 835 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35163.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 624 74.7 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 . 234 28.0 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 . 2 0.2 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 . 84 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.9 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 3 2 11 0 0 0 0 0 0 0 4 0 0 0 0 0 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 . 4 0 0 0 4 0 4 7 9 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 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 21 A K 0 0 240 0, 0.0 2,-0.4 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 126.9 -12.3 -13.0 8.4 2 22 A T > - 0 0 10 1,-0.1 3,-1.5 55,-0.0 4,-0.2 -0.992 360.0-140.6-132.2 140.6 -11.7 -9.5 6.8 3 23 A I T 3 S+ 0 0 50 -2,-0.4 3,-0.4 1,-0.3 4,-0.2 0.680 105.9 62.0 -66.6 -15.4 -13.9 -7.1 4.9 4 24 A W T >> + 0 0 0 1,-0.2 4,-2.5 2,-0.1 3,-0.7 0.401 68.7 111.0 -90.0 3.2 -10.8 -6.4 2.7 5 25 A Q H <> S+ 0 0 82 -3,-1.5 4,-2.5 1,-0.3 -1,-0.2 0.821 76.3 49.1 -53.4 -39.3 -10.6 -10.0 1.4 6 26 A N H 3> S+ 0 0 74 -3,-0.4 4,-1.9 2,-0.2 -1,-0.3 0.852 112.3 48.2 -72.1 -32.7 -11.7 -9.3 -2.2 7 27 A Y H <> S+ 0 0 1 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.928 113.0 48.9 -63.8 -46.5 -9.1 -6.4 -2.5 8 28 A I H X S+ 0 0 18 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.931 111.8 48.6 -58.8 -48.7 -6.4 -8.6 -1.0 9 29 A D H X S+ 0 0 62 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.906 110.1 51.8 -56.3 -45.4 -7.3 -11.5 -3.5 10 30 A A H X S+ 0 0 4 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.909 108.1 52.5 -62.6 -41.7 -7.3 -9.1 -6.4 11 31 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.943 115.6 38.3 -58.2 -52.9 -3.8 -7.8 -5.5 12 32 A F H < S+ 0 0 37 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.740 111.3 58.6 -78.0 -21.1 -2.3 -11.2 -5.3 13 33 A E H < S+ 0 0 147 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.864 111.7 43.9 -66.6 -36.4 -4.2 -12.5 -8.4 14 34 A T H < S+ 0 0 27 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.887 127.7 28.5 -72.2 -41.7 -2.6 -9.7 -10.3 15 35 A F >< + 0 0 2 -4,-2.1 3,-1.6 -5,-0.2 -1,-0.2 -0.647 66.1 161.9-122.1 72.0 0.9 -10.2 -8.8 16 36 A P T 3 + 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.689 67.7 73.7 -69.1 -14.2 1.1 -13.9 -8.0 17 37 A Q T 3 S+ 0 0 46 -3,-0.1 2,-1.4 29,-0.1 27,-0.2 0.615 70.7 101.3 -67.9 -13.5 4.9 -13.7 -7.8 18 38 A L < + 0 0 3 -3,-1.6 2,-0.3 -6,-0.2 27,-0.2 -0.587 52.3 165.5 -83.1 91.5 4.7 -11.9 -4.5 19 39 A E E -A 44 0A 135 25,-2.0 25,-2.1 -2,-1.4 32,-0.1 -0.755 44.9 -90.1-110.0 154.2 5.4 -14.5 -1.9 20 40 A I E +A 43 0A 80 -2,-0.3 23,-0.3 23,-0.2 3,-0.1 -0.397 43.4 166.7 -65.9 127.4 6.3 -14.2 1.7 21 41 A S E S+ 0 0 64 21,-3.3 2,-0.3 1,-0.4 22,-0.2 0.633 70.7 10.6-107.4 -29.5 10.0 -13.9 2.3 22 42 A E E -A 42 0A 98 20,-1.9 20,-3.4 3,-0.0 2,-0.9 -0.973 57.2-144.6-149.3 134.2 9.9 -12.7 5.9 23 43 A V E -A 41 0A 77 -2,-0.3 18,-0.2 18,-0.2 3,-0.1 -0.892 23.3-174.2 -94.2 105.0 7.2 -12.5 8.6 24 44 A W E - 0 0 62 16,-1.5 2,-0.3 -2,-0.9 17,-0.2 0.867 60.0 -4.4 -73.1 -37.4 8.4 -9.4 10.3 25 45 A A E -A 40 0A 7 15,-1.7 15,-2.5 -3,-0.1 2,-0.4 -0.977 38.8-175.7-156.7 141.1 5.9 -9.4 13.2 26 46 A K E +A 39 0A 148 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.915 35.6 178.3-129.0 107.1 2.9 -11.2 14.6 27 47 A W E -A 38 0A 38 11,-2.1 11,-2.4 -2,-0.4 2,-0.4 -0.885 25.9-150.0-115.8 144.3 1.9 -9.1 17.6 28 48 A D E +A 37 0A 98 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.861 39.4 128.8-101.8 146.1 -0.9 -9.2 20.3 29 49 A G E +A 36 0A 13 7,-2.3 7,-2.4 -2,-0.4 6,-0.3 -0.853 22.1 71.8-167.1-159.5 -2.1 -5.9 21.8 30 50 A G S S+ 0 0 30 162,-2.6 2,-0.1 -2,-0.2 -2,-0.0 -0.411 93.7 1.1 70.7-143.1 -5.1 -3.7 22.6 31 51 A N 0 0 105 -2,-0.1 4,-2.3 1,-0.1 5,-0.3 -0.367 360.0 360.0 -78.9 160.3 -7.5 -4.8 25.4 32 52 A V 0 0 187 2,-0.2 -1,-0.1 3,-0.1 -2,-0.0 -0.581 360.0 360.0 -91.7 360.0 -7.0 -7.9 27.6 33 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 34 57 A G 0 0 58 0, 0.0 -2,-0.2 0, 0.0 -4,-0.2 0.000 360.0 360.0 360.0 145.1 -5.0 -9.4 23.3 35 58 A D + 0 0 50 -4,-2.3 2,-0.4 -6,-0.3 -5,-0.2 0.543 360.0 70.6 -84.6 -5.9 -8.0 -8.2 21.3 36 59 A A E -A 29 0A 0 -7,-2.4 -7,-2.3 -5,-0.3 2,-0.4 -0.919 64.0-172.0-111.8 139.3 -5.7 -6.5 18.7 37 60 A K E -AB 28 57A 106 20,-2.5 20,-2.4 -2,-0.4 2,-0.4 -0.991 5.6-164.9-132.8 133.8 -3.5 -8.4 16.3 38 61 A L E -AB 27 56A 1 -11,-2.4 -11,-2.1 -2,-0.4 2,-0.4 -0.979 4.7-176.0-119.7 134.1 -0.8 -7.2 13.9 39 62 A T E -AB 26 55A 34 16,-2.1 16,-2.5 -2,-0.4 2,-0.5 -0.998 3.6-177.3-124.3 125.3 0.6 -9.2 11.1 40 63 A A E -AB 25 54A 0 -15,-2.5 -15,-1.7 -2,-0.4 -16,-1.5 -0.976 9.2-179.4-125.7 112.6 3.5 -7.6 9.1 41 64 A N E -AB 23 53A 18 12,-2.6 12,-2.5 -2,-0.5 2,-0.5 -0.844 20.5-148.5-111.7 144.7 4.8 -9.6 6.2 42 65 A I E -AB 22 52A 30 -20,-3.4 -21,-3.3 -2,-0.3 -20,-1.9 -0.977 20.8-173.0-106.3 127.9 7.6 -8.9 3.7 43 66 A R E -AB 20 51A 42 8,-2.9 8,-3.0 -2,-0.5 2,-0.3 -0.911 3.6-176.0-118.0 150.7 7.0 -10.3 0.2 44 67 A T E +A 19 0A 60 -25,-2.1 -25,-2.0 -2,-0.3 2,-0.3 -0.880 15.1 135.6-138.5 167.8 9.4 -10.4 -2.8 45 68 A G E > - B 0 48A 22 3,-0.7 3,-2.1 -2,-0.3 -27,-0.1 -0.936 55.7 -25.0 165.6 174.2 9.1 -11.6 -6.3 46 69 A E T 3 S+ 0 0 131 -2,-0.3 -29,-0.1 1,-0.2 3,-0.1 -0.193 124.6 1.5 -52.1 125.3 9.9 -10.8 -10.0 47 70 A H T 3 S+ 0 0 23 1,-0.2 24,-2.6 117,-0.1 2,-0.4 0.346 110.2 103.8 77.1 4.0 10.2 -7.0 -10.7 48 71 A F E < -BC 45 70A 3 -3,-2.1 -3,-0.7 22,-0.3 -1,-0.2 -0.929 55.9-160.8-116.8 136.2 9.7 -6.0 -7.0 49 72 A L E S- 0 0 25 20,-2.5 2,-0.3 -2,-0.4 -1,-0.2 0.927 81.5 -40.8 -69.0 -47.8 12.1 -4.8 -4.4 50 73 A K E - C 0 69A 14 19,-1.6 19,-3.1 -6,-0.1 2,-0.5 -0.958 41.3-139.4-167.3 157.9 9.5 -5.8 -1.8 51 74 A A E -BC 43 68A 0 -8,-3.0 -8,-2.9 -2,-0.3 2,-0.6 -0.994 24.7-160.6-118.8 123.0 5.8 -5.7 -1.0 52 75 A R E -BC 42 67A 1 15,-2.4 15,-1.8 -2,-0.5 2,-0.5 -0.918 8.6-170.1-111.7 122.5 5.3 -4.8 2.6 53 76 A E E -BC 41 66A 12 -12,-2.5 -12,-2.6 -2,-0.6 2,-0.4 -0.950 8.2-176.3-122.6 118.5 1.9 -5.8 4.0 54 77 A A E -BC 40 65A 2 11,-2.9 11,-2.8 -2,-0.5 2,-0.4 -0.969 1.4-178.6-113.7 134.9 0.5 -4.8 7.4 55 78 A H E -BC 39 64A 38 -16,-2.5 -16,-2.1 -2,-0.4 2,-0.5 -0.967 1.8-177.0-136.3 115.9 -2.8 -6.0 8.6 56 79 A I E -BC 38 63A 6 7,-2.4 7,-2.9 -2,-0.4 2,-0.4 -0.958 6.6-179.6-115.0 125.7 -4.1 -4.9 12.0 57 80 A V E +BC 37 62A 50 -20,-2.4 -20,-2.5 -2,-0.5 5,-0.2 -0.992 10.8 153.0-129.5 139.0 -7.4 -6.2 13.3 58 81 A D - 0 0 21 3,-2.6 -22,-0.2 -2,-0.4 -28,-0.0 -0.842 61.4 -79.9-142.7-179.6 -9.4 -5.6 16.5 59 82 A P S S+ 0 0 81 0, 0.0 -23,-0.1 0, 0.0 3,-0.0 0.801 129.3 26.1 -54.3 -30.1 -13.1 -5.8 17.5 60 83 A N S S+ 0 0 90 27,-0.1 2,-0.3 1,-0.1 -3,-0.0 0.674 120.6 48.2-103.9 -23.4 -13.9 -2.4 15.9 61 84 A S - 0 0 5 27,-0.1 -3,-2.6 2,-0.0 2,-0.3 -0.828 42.7-175.2-133.7 158.7 -11.2 -2.0 13.2 62 85 A D E -CD 57 85A 9 23,-1.9 23,-2.7 -2,-0.3 2,-0.5 -0.862 16.6-176.9-155.7 107.8 -9.5 -3.7 10.3 63 86 A I E -CD 56 84A 18 -7,-2.9 -7,-2.4 -2,-0.3 2,-0.5 -0.963 8.4-172.3-119.2 125.4 -6.6 -1.9 8.7 64 87 A Y E +CD 55 83A 2 19,-2.9 19,-2.7 -2,-0.5 2,-0.5 -0.955 8.9 177.0-121.0 110.9 -4.8 -3.2 5.6 65 88 A N E +CD 54 82A 18 -11,-2.8 -11,-2.9 -2,-0.5 2,-0.4 -0.954 10.5 160.4-121.0 112.4 -1.7 -1.1 4.8 66 89 A T E -CD 53 81A 0 15,-1.8 15,-2.4 -2,-0.5 2,-0.4 -0.997 18.3-173.1-139.3 132.9 0.4 -2.3 1.8 67 90 A I E -CD 52 80A 3 -15,-1.8 -15,-2.4 -2,-0.4 2,-0.7 -0.999 14.6-149.9-126.9 131.9 3.0 -0.8 -0.5 68 91 A L E -CD 51 79A 0 11,-2.8 11,-1.7 -2,-0.4 -17,-0.2 -0.915 12.3-162.5 -92.0 113.2 4.5 -2.5 -3.5 69 92 A Y E -C 50 0A 0 -19,-3.1 -20,-2.5 -2,-0.7 -19,-1.6 -0.893 14.1-149.1 -95.6 106.9 8.0 -1.1 -4.0 70 93 A P E -C 48 0A 0 0, 0.0 -22,-0.3 0, 0.0 95,-0.1 -0.344 29.0 -87.8 -71.4 160.0 9.0 -2.0 -7.6 71 94 A K - 0 0 46 -24,-2.6 3,-0.3 93,-0.3 5,-0.3 -0.311 53.1-114.3 -53.3 147.8 12.6 -2.7 -8.6 72 95 A T B S+G 166 0B 11 94,-1.6 94,-2.6 1,-0.2 93,-0.6 -0.299 81.8 77.3 -83.8 171.8 14.3 0.6 -9.5 73 96 A G S S+ 0 0 80 91,-0.2 -1,-0.2 92,-0.2 -2,-0.0 0.285 87.0 61.5 112.3 -11.1 15.6 1.6 -13.0 74 97 A A S S- 0 0 30 -3,-0.3 -2,-0.1 2,-0.1 89,-0.0 0.196 101.1-116.5-133.0 17.0 12.5 2.6 -14.8 75 98 A D + 0 0 91 1,-0.2 26,-0.1 24,-0.0 -3,-0.1 0.795 56.7 164.9 53.0 35.6 11.2 5.5 -12.7 76 99 A L - 0 0 14 -5,-0.3 -1,-0.2 1,-0.1 2,-0.1 -0.540 34.3-121.9 -82.2 148.1 8.1 3.6 -11.7 77 100 A P - 0 0 0 0, 0.0 22,-0.3 0, 0.0 2,-0.2 -0.420 26.2-111.0 -75.6 159.7 5.8 4.7 -8.8 78 101 A C E - E 0 98A 0 20,-2.9 20,-2.6 -9,-0.1 2,-0.5 -0.474 26.0-125.8 -71.2 160.3 5.0 2.4 -5.8 79 102 A F E -DE 68 97A 0 -11,-1.7 -11,-2.8 18,-0.2 2,-0.4 -0.980 36.5-176.0-110.9 119.4 1.5 1.1 -5.6 80 103 A G E -DE 67 96A 4 16,-2.8 16,-2.5 -2,-0.5 2,-0.4 -0.880 13.3-177.7-119.8 144.7 0.1 2.0 -2.1 81 104 A X E -DE 66 95A 7 -15,-2.4 -15,-1.8 -2,-0.4 2,-0.4 -1.000 13.5-174.8-141.4 145.3 -3.0 1.3 -0.3 82 105 A D E +DE 65 94A 33 12,-2.6 12,-1.5 -2,-0.4 2,-0.7 -0.899 13.2 180.0-132.7 98.7 -4.5 2.2 3.1 83 106 A L E -DE 64 93A 0 -19,-2.7 -19,-2.9 -2,-0.4 2,-0.6 -0.918 11.6-177.5-107.5 105.8 -7.8 0.4 3.7 84 107 A X E -DE 63 92A 24 8,-2.8 8,-2.7 -2,-0.7 2,-0.7 -0.921 23.0-175.4-119.1 113.5 -9.1 1.4 7.1 85 108 A K E +DE 62 91A 26 -23,-2.7 -23,-1.9 -2,-0.6 6,-0.2 -0.923 11.0 173.4 -95.2 117.1 -12.2 0.2 8.8 86 109 A F E - 0 0 101 4,-2.2 2,-0.3 -2,-0.7 5,-0.2 0.740 62.5 -12.6 -96.4 -26.8 -12.4 2.3 12.0 87 110 A S E > S- E 0 90A 35 3,-1.4 3,-0.5 -25,-0.1 -1,-0.3 -0.929 79.0 -83.6-157.3 178.0 -15.8 1.1 13.2 88 111 A D T 3 S+ 0 0 112 -2,-0.3 3,-0.1 1,-0.2 -27,-0.1 0.591 128.7 41.9 -61.6 -15.3 -19.0 -0.8 12.3 89 112 A K T 3 S+ 0 0 163 1,-0.2 2,-0.4 48,-0.1 -1,-0.2 0.623 111.8 50.9-107.9 -15.9 -20.2 2.4 10.7 90 113 A K E < +E 87 0A 98 -3,-0.5 -4,-2.2 47,-0.1 -3,-1.4 -0.976 45.6 163.8-142.9 126.8 -17.1 3.9 8.9 91 114 A V E -EF 85 136A 1 45,-2.6 45,-1.9 -2,-0.4 2,-0.4 -0.960 16.9-155.7-131.0 154.8 -14.4 3.0 6.5 92 115 A I E -EF 84 135A 24 -8,-2.7 -8,-2.8 -2,-0.3 2,-0.5 -0.998 8.8-161.1-123.8 132.5 -11.9 4.9 4.4 93 116 A I E +EF 83 134A 0 41,-2.5 41,-2.2 -2,-0.4 2,-0.4 -0.972 14.9 172.4-110.4 121.8 -10.4 3.4 1.2 94 117 A V E +EF 82 133A 21 -12,-1.5 -12,-2.6 -2,-0.5 2,-0.3 -0.998 5.8 155.3-127.0 133.2 -7.3 4.9 -0.1 95 118 A F E +EF 81 132A 1 37,-2.0 37,-2.6 -2,-0.4 2,-0.3 -0.982 11.9 149.5-147.9 152.5 -5.1 3.6 -3.0 96 119 A D E -E 80 0A 2 -16,-2.5 -16,-2.8 -2,-0.3 2,-0.7 -0.995 50.9 -95.8-167.9 160.5 -2.7 5.3 -5.3 97 120 A F E -E 79 0A 0 -2,-0.3 2,-0.7 -18,-0.2 31,-0.6 -0.860 42.7-161.4 -82.5 115.2 0.4 5.4 -7.5 98 121 A Q E -E 78 0A 8 -20,-2.6 -20,-2.9 -2,-0.7 29,-0.2 -0.874 4.0-152.2-111.6 103.4 3.0 6.9 -5.1 99 122 A H - 0 0 3 -2,-0.7 5,-0.1 -22,-0.3 -23,-0.1 -0.505 10.9-142.1 -81.7 136.1 6.0 8.2 -7.1 100 123 A P S S+ 0 0 5 0, 0.0 2,-0.3 0, 0.0 75,-0.2 0.787 75.0 95.8 -68.8 -25.4 9.4 8.2 -5.3 101 124 A R S > S- 0 0 111 -26,-0.1 3,-0.7 1,-0.1 25,-0.5 -0.498 82.2-118.0 -65.8 126.1 10.4 11.6 -6.9 102 125 A E T 3 S+ 0 0 70 -2,-0.3 425,-0.2 1,-0.2 23,-0.1 -0.405 89.8 0.8 -63.8 139.5 9.7 14.6 -4.6 103 126 A K T 3 S+ 0 0 56 1,-0.2 424,-3.0 423,-0.1 2,-0.4 0.899 94.8 139.4 48.6 54.7 7.2 17.2 -6.0 104 127 A Y < - 0 0 35 -3,-0.7 2,-0.5 20,-0.5 22,-0.4 -0.981 50.2-134.8-134.0 120.0 6.7 15.3 -9.2 105 128 A L - 0 0 24 -2,-0.4 2,-0.4 441,-0.3 23,-0.1 -0.601 26.3-177.5 -82.0 116.2 3.2 15.0 -10.7 106 129 A F + 0 0 31 -2,-0.5 23,-2.6 21,-0.3 24,-0.3 -0.899 8.1 162.2-110.9 144.8 2.4 11.5 -11.8 107 130 A S - 0 0 54 -2,-0.4 2,-0.5 21,-0.2 6,-0.0 -0.984 34.0-143.9-156.3 164.6 -0.8 10.4 -13.6 108 131 A V > - 0 0 19 -2,-0.3 3,-1.8 4,-0.1 2,-0.1 -0.974 31.5-132.4-131.1 104.7 -2.3 7.7 -15.7 109 132 A D T 3 S+ 0 0 40 -2,-0.5 -2,-0.0 1,-0.2 430,-0.0 -0.440 92.7 40.2 -68.0 133.5 -4.7 9.2 -18.3 110 133 A G T 3 S+ 0 0 0 1,-0.5 -1,-0.2 -2,-0.1 3,-0.1 0.117 93.3 103.1 113.7 -17.9 -8.0 7.3 -18.2 111 134 A L S < S- 0 0 1 -3,-1.8 -1,-0.5 1,-0.1 633,-0.1 -0.607 85.0 -87.5 -93.3 158.3 -8.2 6.8 -14.4 112 135 A P - 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0 0 4 -31,-0.6 3,-1.7 -2,-0.3 -21,-0.2 -0.305 26.8-101.3 -93.2 174.1 -0.7 11.0 -8.0 129 152 A K T 3 S+ 0 0 39 -23,-2.6 -15,-2.1 1,-0.3 -22,-0.1 0.701 122.7 56.3 -61.8 -19.2 -3.4 12.9 -9.9 130 153 A N T 3 S+ 0 0 0 -24,-0.3 -1,-0.3 -17,-0.2 -35,-0.1 0.158 70.7 152.9-105.1 18.9 -5.4 9.7 -9.6 131 154 A I < - 0 0 10 -3,-1.7 2,-0.6 -17,-0.1 -35,-0.2 -0.213 35.6-146.4 -47.6 129.8 -5.3 9.3 -5.8 132 155 A F E +F 95 0A 1 -37,-2.6 -37,-2.0 -18,-0.1 2,-0.4 -0.923 27.0 164.6-113.1 113.4 -8.4 7.3 -4.9 133 156 A V E +F 94 0A 9 -2,-0.6 2,-0.3 -39,-0.2 -39,-0.2 -0.995 3.6 165.4-130.5 126.8 -10.1 8.1 -1.6 134 157 A R E -F 93 0A 42 -41,-2.2 -41,-2.5 -2,-0.4 2,-0.4 -0.979 22.3-150.0-137.1 152.9 -13.6 7.1 -0.6 135 158 A Y E +F 92 0A 59 -2,-0.3 2,-0.3 -43,-0.2 -43,-0.2 -0.963 36.4 130.0-119.6 137.5 -15.6 7.0 2.6 136 159 A C E -F 91 0A 6 -45,-1.9 -45,-2.6 -2,-0.4 5,-0.0 -0.959 55.2 -70.8-165.0-179.6 -18.4 4.4 3.2 137 160 A K > - 0 0 110 -2,-0.3 3,-2.1 -47,-0.2 4,-0.4 -0.544 49.0-111.6 -81.0 151.9 -20.0 1.7 5.3 138 161 A P G > S+ 0 0 17 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.813 117.7 56.8 -56.8 -31.9 -18.2 -1.7 5.7 139 162 A D G 3 S+ 0 0 131 1,-0.2 3,-0.1 2,-0.1 0, 0.0 0.479 104.6 56.5 -75.5 -4.0 -20.9 -3.5 3.6 140 163 A E G X S+ 0 0 58 -3,-2.1 3,-1.8 1,-0.1 4,-0.2 0.444 73.4 99.5-106.6 -5.1 -20.3 -1.0 0.8 141 164 A V G X S+ 0 0 4 -3,-0.9 3,-1.7 -4,-0.4 -1,-0.1 0.819 73.5 62.3 -60.7 -35.6 -16.5 -1.5 0.1 142 165 A D G > S+ 0 0 68 1,-0.3 3,-1.6 -4,-0.2 4,-0.4 0.649 81.3 82.7 -71.8 -8.2 -16.8 -3.9 -2.8 143 166 A Q G < S+ 0 0 77 -3,-1.8 -1,-0.3 1,-0.3 4,-0.2 0.753 97.6 43.4 -61.5 -21.0 -18.6 -1.1 -4.8 144 167 A Y G <> S+ 0 0 9 -3,-1.7 4,-2.5 -4,-0.2 -1,-0.3 0.298 85.7 97.7-104.4 8.0 -15.1 0.2 -5.6 145 168 A L H <> S+ 0 0 18 -3,-1.6 4,-2.7 1,-0.2 5,-0.2 0.873 80.1 53.8 -67.2 -39.0 -13.4 -3.2 -6.3 146 169 A D H > S+ 0 0 27 -4,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.893 110.3 47.6 -64.7 -39.1 -13.8 -2.8 -10.1 147 170 A T H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 3,-0.3 0.941 110.1 52.0 -66.2 -44.1 -12.0 0.5 -10.0 148 171 A F H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.925 107.6 53.7 -53.2 -45.1 -9.3 -1.0 -7.8 149 172 A K H X S+ 0 0 84 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.837 105.0 54.0 -61.0 -33.7 -8.9 -3.8 -10.4 150 173 A L H X S+ 0 0 10 -4,-1.5 4,-2.5 -3,-0.3 -1,-0.2 0.921 108.4 49.0 -65.4 -41.7 -8.4 -1.1 -13.1 151 174 A Y H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.925 111.7 49.7 -64.8 -42.1 -5.5 0.5 -11.0 152 175 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 2,-0.2 -1,-0.2 0.894 109.1 52.1 -58.6 -43.3 -4.0 -3.0 -10.6 153 176 A T H X S+ 0 0 56 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.939 110.9 47.0 -59.4 -49.1 -4.3 -3.6 -14.4 154 177 A K H X S+ 0 0 20 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.894 113.8 48.8 -59.9 -40.0 -2.5 -0.3 -15.2 155 178 A Y H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.935 109.7 49.7 -68.9 -44.6 0.2 -1.1 -12.6 156 179 A K H X S+ 0 0 84 -4,-3.1 4,-3.0 1,-0.2 5,-0.3 0.913 109.6 54.5 -59.8 -40.4 0.7 -4.7 -13.9 157 180 A E H X S+ 0 0 59 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.939 108.8 46.8 -56.3 -48.0 1.0 -3.1 -17.4 158 181 A X H X S+ 0 0 26 -4,-2.3 4,-2.2 2,-0.2 5,-0.3 0.930 115.1 46.0 -64.3 -42.0 3.8 -0.7 -16.3 159 182 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.954 116.2 44.9 -56.4 -52.6 5.7 -3.5 -14.5 160 183 A D H < S+ 0 0 52 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.849 117.5 44.5 -67.0 -34.7 5.4 -5.9 -17.4 161 184 A N H < S+ 0 0 132 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.822 123.4 33.1 -80.7 -33.9 6.3 -3.3 -20.0 162 185 A N H < S- 0 0 83 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.760 81.8-161.6 -94.7 -27.4 9.2 -1.7 -18.2 163 186 A K < - 0 0 120 -4,-2.9 -3,-0.1 -5,-0.3 -4,-0.1 0.901 15.1-154.4 48.5 58.1 10.6 -4.8 -16.4 164 187 A P + 0 0 3 0, 0.0 -93,-0.3 0, 0.0 -91,-0.2 -0.288 23.9 173.6 -66.8 146.7 12.7 -3.0 -13.8 165 188 A V + 0 0 108 -93,-0.6 -92,-0.2 -95,-0.1 -93,-0.1 0.424 35.3 117.0-127.9 -4.4 15.6 -4.9 -12.3 166 189 A G B -G 72 0B 22 -94,-2.6 -94,-1.6 1,-0.1 -92,-0.1 -0.286 44.3-161.2 -71.1 152.7 17.5 -2.3 -10.1 167 190 A E + 0 0 134 -96,-0.2 2,-1.3 -94,-0.0 3,-0.1 -0.146 38.9 138.8-126.5 42.4 17.9 -2.8 -6.4 168 191 A D > - 0 0 77 1,-0.2 3,-2.2 2,-0.1 4,-0.3 -0.668 25.6-178.8 -91.8 87.6 18.7 0.8 -5.3 169 192 A T G > S+ 0 0 53 -2,-1.3 3,-1.6 1,-0.3 -1,-0.2 0.722 74.5 74.4 -62.3 -20.9 16.7 1.3 -2.2 170 193 A T G > S+ 0 0 93 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.721 78.5 74.7 -68.0 -18.6 17.9 4.9 -1.9 171 194 A V G < S+ 0 0 57 -3,-2.2 4,-0.3 1,-0.2 3,-0.3 0.866 100.3 45.3 -53.0 -34.7 15.5 5.7 -4.7 172 195 A Y G <> S+ 0 0 3 -3,-1.6 4,-3.1 -4,-0.3 5,-0.3 0.357 84.3 98.1 -96.2 7.0 12.8 5.4 -2.0 173 196 A S H <> S+ 0 0 27 -3,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.920 85.1 44.8 -63.7 -47.5 14.6 7.4 0.7 174 197 A D H > S+ 0 0 92 -4,-0.4 4,-2.6 -3,-0.3 -1,-0.2 0.913 116.0 49.8 -64.3 -40.6 12.8 10.7 0.1 175 198 A F H > S+ 0 0 0 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.948 112.3 44.3 -61.7 -54.1 9.5 8.8 -0.1 176 199 A D H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.841 113.6 52.9 -63.4 -30.8 9.9 6.8 3.1 177 200 A T H X S+ 0 0 41 -4,-2.2 4,-2.2 -5,-0.3 -2,-0.2 0.939 109.9 47.1 -67.0 -50.7 11.1 10.0 4.9 178 201 A Y H X S+ 0 0 7 -4,-2.6 4,-1.9 2,-0.2 5,-0.2 0.931 114.5 46.7 -53.5 -50.4 8.0 11.9 3.8 179 202 A X H X S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.911 111.2 51.6 -64.9 -41.5 5.7 9.1 4.9 180 203 A T H < S+ 0 0 12 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.919 113.3 46.2 -58.7 -43.4 7.5 8.7 8.2 181 204 A E H < S+ 0 0 138 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.803 126.6 24.9 -66.1 -33.8 7.1 12.4 8.9 182 205 A L H < S+ 0 0 62 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.627 86.0 109.3-113.6 -22.4 3.4 12.8 7.9 183 206 A D >< - 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0 0 28 -4,-1.8 4,-2.3 -5,-0.6 -1,-0.2 -0.215 37.4 -73.8 105.3 166.3 -26.7 11.3 -50.7 828 218 D E H > S+ 0 0 87 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.925 124.3 45.9 -68.3 -54.6 -29.8 13.0 -49.3 829 219 D G H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.888 116.8 47.1 -55.5 -42.4 -32.3 10.1 -49.0 830 220 D R H > S+ 0 0 102 -4,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.892 111.9 49.6 -69.7 -41.6 -29.5 7.8 -47.5 831 221 D S H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.951 112.4 47.6 -61.1 -50.0 -28.4 10.5 -45.0 832 222 D E H X S+ 0 0 66 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.894 115.5 43.5 -57.4 -49.2 -32.0 11.2 -43.8 833 223 D A H X>S+ 0 0 19 -4,-2.1 4,-2.7 2,-0.2 5,-0.8 0.886 110.7 56.2 -66.2 -39.5 -32.9 7.5 -43.4 834 224 D F H X>S+ 0 0 3 -4,-2.3 5,-2.9 -5,-0.2 4,-0.5 0.922 116.1 36.9 -59.9 -43.6 -29.6 6.8 -41.7 835 225 D V H <>S+ 0 0 6 -4,-2.2 5,-2.5 3,-0.2 -2,-0.2 0.948 129.0 29.4 -72.0 -49.0 -30.3 9.4 -39.1 836 226 D N H <5S+ 0 0 38 -4,-2.7 7,-0.2 -5,-0.2 -3,-0.2 0.654 129.6 32.9 -94.6 -21.8 -34.0 9.0 -38.6 837 227 D D H <5S+ 0 0 90 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.490 133.1 20.6-112.1 -12.1 -34.6 5.3 -39.3 838 228 D F T <