==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSFER(CUPROPROTEIN) 28-JUN-88 1PAZ . COMPND 2 MOLECULE: PSEUDOAZURIN PRECURSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ALCALIGENES FAECALIS; . AUTHOR K.PETRATOS,Z.DAUTER,K.S.WILSON . 120 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6307.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 80 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 20.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 1 1 0 1 1 1 0 0 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 . 0 0 1 1 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 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 1 A E 0 0 169 0, 0.0 29,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 165.1 19.4 4.6 31.6 2 2 A N E -a 30 0A 82 27,-0.2 2,-0.4 29,-0.1 29,-0.2 -0.884 360.0-161.9-116.9 142.5 20.5 7.6 33.7 3 3 A I E -a 31 0A 31 27,-1.7 29,-2.9 -2,-0.4 2,-0.4 -0.996 14.9-145.0-122.6 124.1 18.9 9.1 36.8 4 4 A E E -a 32 0A 103 -2,-0.4 2,-0.4 27,-0.2 29,-0.2 -0.782 15.2-171.7 -97.9 133.8 19.9 12.7 37.7 5 5 A V E -a 33 0A 0 27,-3.0 29,-3.2 -2,-0.4 2,-0.4 -0.989 11.4-145.9-124.2 133.2 20.2 13.6 41.4 6 6 A H E -aB 34 19A 61 13,-2.9 13,-2.4 -2,-0.4 2,-0.6 -0.835 5.4-146.0-102.7 141.7 20.7 17.2 42.8 7 7 A M E +aB 35 18A 0 27,-2.5 30,-1.7 -2,-0.4 29,-0.9 -0.940 32.4 177.2-106.6 117.1 22.7 17.9 45.9 8 8 A L E - B 0 17A 22 9,-2.7 9,-2.2 -2,-0.6 3,-0.1 -0.927 44.2-139.0-128.1 151.9 21.1 20.9 47.7 9 9 A N E S+ 0 0 57 -2,-0.3 7,-2.9 1,-0.3 2,-0.3 0.808 99.0 13.4 -75.3 -29.3 21.4 23.0 50.9 10 10 A K E S+ B 0 15A 130 5,-0.3 -1,-0.3 6,-0.1 5,-0.3 -0.988 73.6 149.0-147.6 143.5 17.6 23.0 51.3 11 11 A G E > - B 0 14A 28 3,-3.1 3,-1.2 -2,-0.3 8,-0.0 -0.733 63.6 -58.6-152.9-163.4 14.9 21.0 49.6 12 12 A A T 3 S+ 0 0 92 1,-0.3 3,-0.1 -2,-0.2 7,-0.0 0.838 131.6 46.4 -58.3 -41.1 11.4 19.6 50.3 13 13 A E T 3 S- 0 0 101 1,-0.2 2,-0.3 101,-0.0 -1,-0.3 0.455 120.5 -99.2 -82.9 -4.1 12.7 17.5 53.3 14 14 A G E < S-B 11 0A 29 -3,-1.2 -3,-3.1 3,-0.0 2,-0.2 -0.941 71.0 -2.0 127.9-147.4 14.7 20.4 54.9 15 15 A A E S+B 10 0A 31 -2,-0.3 -5,-0.3 -5,-0.3 -6,-0.1 -0.600 113.2 14.6 -87.1 151.4 18.3 21.2 54.9 16 16 A M E S+ 0 0 24 -7,-2.9 2,-0.3 -2,-0.2 -7,-0.2 0.986 85.0 160.6 54.8 78.5 21.1 19.3 53.3 17 17 A V E -B 8 0A 8 -9,-2.2 -9,-2.7 -3,-0.2 2,-0.5 -0.897 44.1-136.9-133.4 160.6 19.4 16.9 50.9 18 18 A F E -B 7 0A 5 69,-0.5 -11,-0.2 -2,-0.3 69,-0.1 -0.932 36.2-126.5-103.4 133.2 19.7 14.7 47.9 19 19 A E E S+B 6 0A 64 -13,-2.4 -13,-2.9 -2,-0.5 2,-0.1 -0.980 99.1 24.2-129.8 115.4 16.7 15.0 45.4 20 20 A P S S- 0 0 59 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.638 76.1-175.6 -74.8 161.5 15.5 12.4 44.8 21 21 A A S S+ 0 0 23 1,-0.1 68,-3.1 -2,-0.1 2,-0.5 0.400 74.5 60.4-100.9 -4.2 16.6 10.6 48.0 22 22 A Y E -d 89 0B 110 66,-0.2 2,-0.5 96,-0.1 68,-0.2 -0.989 69.1-176.2-125.3 115.0 15.1 7.3 46.7 23 23 A I E -d 90 0B 3 66,-3.0 68,-3.6 -2,-0.5 2,-0.6 -0.975 11.2-160.7-121.3 122.4 16.6 6.0 43.4 24 24 A K E +d 91 0B 83 -2,-0.5 2,-0.3 66,-0.2 68,-0.2 -0.904 28.2 156.8-100.4 123.1 15.3 2.9 41.7 25 25 A A E -d 92 0B 1 66,-2.8 68,-2.2 -2,-0.6 -23,-0.0 -0.877 33.0-134.2-141.7 172.2 17.8 1.5 39.2 26 26 A N > - 0 0 77 -2,-0.3 3,-2.8 66,-0.2 42,-0.2 -0.893 48.7 -74.4-125.2 156.6 18.9 -1.7 37.3 27 27 A P T 3 S+ 0 0 68 0, 0.0 42,-0.3 0, 0.0 3,-0.1 -0.258 122.5 27.3 -51.6 131.1 22.3 -3.2 36.8 28 28 A G T 3 S+ 0 0 51 40,-4.0 41,-0.1 1,-0.4 42,-0.0 0.190 92.0 125.3 99.5 -15.3 24.1 -1.1 34.2 29 29 A D < - 0 0 19 -3,-2.8 39,-2.4 39,-0.4 -1,-0.4 -0.314 52.7-134.4 -73.4 162.8 22.2 2.2 34.9 30 30 A T E -aC 2 67A 36 -29,-2.4 -27,-1.7 37,-0.2 2,-0.5 -0.891 7.5-155.3-118.6 149.4 24.0 5.4 35.8 31 31 A V E -aC 3 66A 0 35,-2.6 35,-3.1 -2,-0.3 2,-0.6 -0.999 11.7-155.6-121.5 120.9 23.2 7.8 38.6 32 32 A T E -aC 4 65A 16 -29,-2.9 -27,-3.0 -2,-0.5 2,-0.6 -0.911 2.3-156.9-103.8 120.4 24.5 11.4 38.0 33 33 A F E -aC 5 64A 0 31,-3.4 31,-2.2 -2,-0.6 -27,-0.2 -0.877 9.1-166.6-100.0 118.0 25.0 13.5 41.1 34 34 A I E -a 6 0A 35 -29,-3.2 -27,-2.5 -2,-0.6 2,-1.7 -0.929 17.5-142.3-111.8 118.3 24.9 17.3 40.4 35 35 A P E +a 7 0A 22 0, 0.0 -27,-0.1 0, 0.0 -29,-0.1 -0.614 28.5 168.6 -79.2 86.4 26.1 19.7 43.0 36 36 A V S S+ 0 0 74 -2,-1.7 2,-0.3 -29,-0.9 -28,-0.2 0.891 74.9 33.2 -65.5 -42.4 23.5 22.4 42.5 37 37 A D S S- 0 0 52 -30,-1.7 3,-0.4 -3,-0.2 24,-0.1 -0.827 98.8-111.0-109.0 151.3 24.8 24.1 45.7 38 38 A K S S+ 0 0 173 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.422 89.3 57.5 -81.2 160.7 28.5 23.9 46.7 39 39 A G S S+ 0 0 25 1,-0.3 2,-0.3 -2,-0.1 -1,-0.2 0.493 82.0 107.1 100.8 7.0 29.7 22.0 49.6 40 40 A H + 0 0 0 -3,-0.4 21,-2.8 -33,-0.1 -1,-0.3 -0.818 31.0 159.9-121.3 157.6 28.5 18.5 48.7 41 41 A N - 0 0 2 -2,-0.3 2,-0.4 19,-0.2 19,-0.1 -0.826 32.7-115.4-151.1-173.2 29.8 15.2 47.5 42 42 A V + 0 0 0 -2,-0.3 16,-3.1 36,-0.2 2,-0.3 -0.997 30.4 170.9-138.3 136.4 28.7 11.5 47.5 43 43 A E E -EF 57 77B 43 34,-2.4 34,-2.8 -2,-0.4 14,-0.2 -0.988 34.1-114.4-147.7 138.7 30.3 8.6 49.3 44 44 A S E - F 0 76B 7 12,-2.7 2,-0.4 -2,-0.3 32,-0.2 -0.465 33.6-122.9 -71.7 144.1 29.2 5.0 49.9 45 45 A I > - 0 0 12 30,-1.9 3,-2.3 3,-0.2 30,-0.2 -0.752 33.2-102.0 -90.9 132.0 28.6 4.1 53.6 46 46 A K T 3 S+ 0 0 159 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 -0.251 103.5 2.7 -55.2 133.5 30.7 1.2 55.0 47 47 A D T 3 S+ 0 0 108 1,-0.1 -1,-0.3 3,-0.1 4,-0.1 0.505 110.7 95.1 62.5 14.7 28.7 -2.0 55.2 48 48 A M < + 0 0 12 -3,-2.3 27,-2.6 27,-0.2 -3,-0.2 -0.058 69.6 72.5-119.8 29.5 25.7 -0.3 53.6 49 49 A I S S- 0 0 23 25,-0.2 25,-0.2 -5,-0.1 3,-0.1 -0.911 94.8 -82.6-134.3 155.6 26.3 -1.3 50.0 50 50 A P > - 0 0 10 0, 0.0 3,-2.0 0, 0.0 2,-0.3 -0.137 51.4 -89.4 -61.4 155.2 25.9 -4.8 48.5 51 51 A E T 3 S+ 0 0 192 1,-0.3 3,-0.1 -4,-0.1 0, 0.0 -0.503 116.8 22.9 -66.7 127.2 28.4 -7.6 48.8 52 52 A G T 3 S+ 0 0 70 1,-0.4 -1,-0.3 -2,-0.3 2,-0.2 0.287 92.6 122.2 97.8 -9.2 30.7 -7.3 45.9 53 53 A A < - 0 0 16 -3,-2.0 -1,-0.4 18,-0.1 2,-0.3 -0.625 63.3-118.9 -84.0 147.5 30.0 -3.6 45.1 54 54 A E - 0 0 140 -2,-0.2 -1,-0.0 -3,-0.1 -10,-0.0 -0.681 25.2-114.4 -89.8 142.2 33.1 -1.2 45.1 55 55 A K - 0 0 127 -2,-0.3 2,-0.3 -6,-0.1 -1,-0.1 -0.316 37.2-166.5 -65.9 153.5 33.2 1.7 47.6 56 56 A F + 0 0 13 2,-0.0 -12,-2.7 10,-0.0 2,-0.3 -0.984 18.5 179.9-148.3 153.9 33.1 5.1 46.1 57 57 A K B -E 43 0B 134 -2,-0.3 -14,-0.2 -14,-0.2 2,-0.2 -0.879 13.7-155.3-157.2 119.4 33.8 8.7 47.1 58 58 A S - 0 0 5 -16,-3.1 2,-0.3 -2,-0.3 6,-0.1 -0.469 28.7 -99.3 -91.8 166.2 33.4 11.8 44.9 59 59 A K > - 0 0 145 -2,-0.2 3,-2.1 1,-0.1 -19,-0.1 -0.630 48.1 -91.0 -85.6 146.9 35.2 15.1 45.3 60 60 A I T 3 S+ 0 0 90 1,-0.3 -19,-0.2 -2,-0.3 -1,-0.1 -0.301 111.5 9.2 -56.8 132.4 33.3 18.0 46.9 61 61 A N T 3 S+ 0 0 74 -21,-2.8 2,-0.3 1,-0.2 -1,-0.3 0.379 98.3 127.5 74.7 3.6 31.6 20.1 44.2 62 62 A E < - 0 0 48 -3,-2.1 2,-0.5 -22,-0.3 -1,-0.2 -0.647 66.2-117.9 -94.5 145.8 32.2 17.7 41.4 63 63 A N - 0 0 96 -2,-0.3 2,-0.4 -29,-0.1 -29,-0.2 -0.712 41.2-160.9 -72.5 125.0 29.5 16.2 39.0 64 64 A Y E -C 33 0A 46 -31,-2.2 -31,-3.4 -2,-0.5 2,-0.6 -0.967 15.0-159.7-120.7 132.1 29.8 12.5 39.8 65 65 A V E -C 32 0A 84 -2,-0.4 2,-0.5 -33,-0.2 -33,-0.2 -0.950 10.8-166.5-112.8 115.6 28.6 9.7 37.6 66 66 A L E -C 31 0A 13 -35,-3.1 -35,-2.6 -2,-0.6 2,-0.5 -0.877 8.4-152.8-101.1 129.2 28.1 6.4 39.4 67 67 A T E -C 30 0A 85 -2,-0.5 2,-0.5 -37,-0.2 -37,-0.2 -0.915 14.4-148.0 -99.5 127.3 27.6 3.2 37.4 68 68 A V + 0 0 1 -39,-2.4 -40,-4.0 -2,-0.5 -39,-0.4 -0.873 32.4 152.1-102.5 124.9 25.6 0.6 39.4 69 69 A T + 0 0 85 -2,-0.5 -1,-0.2 -42,-0.3 -40,-0.1 0.773 50.1 69.3-109.8 -64.0 26.3 -3.1 38.8 70 70 A Q S S- 0 0 71 -20,-0.1 -1,-0.1 -43,-0.1 22,-0.1 -0.376 78.3-125.0 -69.1 131.8 25.5 -5.2 41.9 71 71 A P + 0 0 73 0, 0.0 2,-0.2 0, 0.0 22,-0.2 -0.367 67.3 69.4 -68.9 155.8 21.8 -5.7 42.8 72 72 A G E S- G 0 92B 7 20,-2.7 20,-3.1 -22,-0.1 2,-0.3 -0.711 85.8 -51.0 125.9-174.1 20.8 -4.7 46.3 73 73 A A E - G 0 91B 0 -2,-0.2 2,-0.4 18,-0.2 18,-0.2 -0.714 41.0-166.0-102.0 147.1 20.4 -1.5 48.3 74 74 A Y E - G 0 90B 8 16,-2.4 16,-2.8 -2,-0.3 2,-0.6 -0.994 7.2-158.1-131.8 125.8 23.1 1.2 48.7 75 75 A L E - G 0 89B 0 -27,-2.6 -30,-1.9 -2,-0.4 2,-0.3 -0.939 19.5-175.2-104.9 123.9 22.9 4.0 51.3 76 76 A V E -FG 44 88B 0 12,-2.7 12,-1.9 -2,-0.6 2,-0.3 -0.824 3.5-164.6-113.2 156.4 25.1 6.9 50.2 77 77 A K E -FG 43 87B 40 -34,-2.8 -34,-2.4 -2,-0.3 2,-0.6 -0.882 29.3-115.6-133.6 167.0 25.9 10.0 52.2 78 78 A C > - 0 0 0 8,-2.0 4,-0.9 -2,-0.3 8,-0.2 -0.945 36.1-136.3 -96.1 121.4 27.3 13.5 51.5 79 79 A T T >4 S+ 0 0 49 -2,-0.6 3,-0.9 1,-0.2 4,-0.3 0.927 97.8 40.4 -50.0 -58.2 30.5 13.3 53.6 80 80 A P T 34 S+ 0 0 63 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.846 124.0 38.7 -62.1 -34.2 30.3 16.8 55.2 81 81 A H T >4>S+ 0 0 29 1,-0.2 5,-2.0 5,-0.1 3,-1.3 0.258 76.2 109.9-108.6 18.8 26.6 16.6 55.9 82 82 A Y G X<5S+ 0 0 39 -3,-0.9 3,-2.4 -4,-0.9 -1,-0.2 0.921 82.1 51.3 -55.0 -49.5 25.9 13.0 56.9 83 83 A A G 3 5S+ 0 0 74 -4,-0.3 -1,-0.3 1,-0.3 27,-0.3 0.677 105.6 57.1 -65.9 -15.1 25.2 13.9 60.5 84 84 A M G < 5S- 0 0 89 -3,-1.3 -1,-0.3 26,-0.1 -2,-0.2 0.361 127.5 -99.7 -94.7 3.7 22.7 16.5 59.2 85 85 A G T < 5 + 0 0 1 -3,-2.4 2,-1.6 -4,-0.2 -3,-0.2 0.600 66.3 156.4 91.7 18.8 20.8 13.7 57.4 86 86 A M < + 0 0 0 -5,-2.0 -8,-2.0 -8,-0.2 2,-0.3 -0.608 28.4 128.3 -82.3 91.8 22.2 14.1 53.8 87 87 A I E - G 0 77B 5 -2,-1.6 -69,-0.5 -10,-0.2 2,-0.3 -0.893 39.4-160.5-139.8 164.9 21.6 10.6 52.4 88 88 A A E - G 0 76B 0 -12,-1.9 -12,-2.7 -2,-0.3 2,-0.5 -0.985 13.9-140.7-143.4 149.2 20.1 8.8 49.5 89 89 A L E -dG 22 75B 2 -68,-3.1 -66,-3.0 -2,-0.3 2,-0.5 -0.970 11.9-163.5-114.3 125.3 19.0 5.2 49.0 90 90 A I E -dG 23 74B 0 -16,-2.8 -16,-2.4 -2,-0.5 2,-0.6 -0.946 3.9-162.9-107.4 126.3 19.7 3.5 45.7 91 91 A A E -dG 24 73B 4 -68,-3.6 -66,-2.8 -2,-0.5 2,-0.6 -0.976 5.4-166.5-112.1 114.0 17.7 0.2 45.1 92 92 A V E -dG 25 72B 1 -20,-3.1 -20,-2.7 -2,-0.6 -66,-0.2 -0.919 56.9 -16.5-106.3 121.1 19.1 -1.9 42.3 93 93 A G S S- 0 0 11 -68,-2.2 2,-0.2 -2,-0.6 -68,-0.2 -0.165 101.9 -46.3 78.7-179.2 16.9 -4.7 41.1 94 94 A D S S+ 0 0 140 1,-0.2 3,-0.2 -23,-0.0 -2,-0.1 -0.515 113.2 5.5 -86.7 153.7 13.9 -6.0 42.9 95 95 A S S S- 0 0 115 -2,-0.2 -1,-0.2 1,-0.2 -22,-0.1 0.851 81.4-135.1 36.4 69.0 13.6 -6.9 46.6 96 96 A P > - 0 0 27 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.307 6.7-145.0 -52.7 121.0 17.1 -5.8 47.7 97 97 A A T 3 S+ 0 0 105 1,-0.3 4,-0.2 -3,-0.2 3,-0.2 0.713 95.0 46.6 -63.1 -27.7 18.4 -8.6 49.9 98 98 A N T 3> S+ 0 0 24 1,-0.2 4,-2.3 2,-0.1 -1,-0.3 0.275 80.1 100.7-100.2 9.7 20.2 -6.1 52.2 99 99 A L H <> S+ 0 0 43 -3,-1.4 4,-2.7 1,-0.2 5,-0.2 0.908 83.3 47.2 -61.2 -47.7 17.5 -3.5 52.8 100 100 A D H > S+ 0 0 129 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.872 111.8 52.8 -60.7 -39.2 16.4 -4.7 56.2 101 101 A Q H > S+ 0 0 86 -4,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.932 109.9 47.0 -61.2 -49.1 20.0 -4.9 57.3 102 102 A I H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.912 110.4 53.6 -60.9 -42.2 20.6 -1.2 56.2 103 103 A V H 3< S+ 0 0 37 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.890 113.3 43.7 -59.2 -39.6 17.3 -0.2 58.0 104 104 A S H 3< S+ 0 0 105 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.619 90.9 112.2 -77.9 -21.4 18.6 -1.8 61.2 105 105 A A S << S- 0 0 22 -4,-1.2 2,-0.3 -3,-0.6 -3,-0.0 -0.155 79.4 -94.5 -61.9 151.9 22.2 -0.5 61.0 106 106 A K + 0 0 206 6,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.514 64.7 139.7 -66.3 126.6 23.7 2.0 63.4 107 107 A K - 0 0 28 -2,-0.3 5,-0.1 -3,-0.1 -24,-0.0 -0.963 56.5 -67.5-163.0 160.7 23.4 5.6 62.0 108 108 A P > - 0 0 42 0, 0.0 4,-2.9 0, 0.0 5,-0.2 -0.200 44.3-119.4 -54.9 147.2 22.5 9.1 63.2 109 109 A K H > S+ 0 0 156 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.866 114.5 51.5 -57.9 -42.9 19.0 9.7 64.3 110 110 A I H > S+ 0 0 53 -27,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.907 111.1 49.1 -61.8 -40.1 18.4 12.3 61.7 111 111 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.944 110.2 50.7 -61.3 -49.4 19.6 9.9 59.1 112 112 A Q H X S+ 0 0 38 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.925 109.3 51.2 -56.7 -45.3 17.4 7.1 60.4 113 113 A E H X S+ 0 0 96 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.941 112.0 45.6 -60.6 -47.9 14.3 9.4 60.3 114 114 A R H X S+ 0 0 35 -4,-2.5 4,-3.2 1,-0.2 -1,-0.2 0.888 112.2 52.0 -61.4 -40.6 15.0 10.5 56.7 115 115 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.908 108.1 50.5 -59.5 -45.5 15.6 6.9 55.6 116 116 A E H X S+ 0 0 106 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.922 113.1 47.4 -60.2 -42.6 12.4 5.7 57.1 117 117 A K H >< S+ 0 0 122 -4,-2.0 3,-0.6 -5,-0.2 -2,-0.2 0.938 111.6 48.5 -64.5 -50.5 10.6 8.4 55.3 118 118 A V H 3< S+ 0 0 33 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.903 110.5 52.2 -56.2 -45.9 12.3 7.7 51.9 119 119 A I H 3< 0 0 71 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.766 360.0 360.0 -60.6 -29.7 11.5 4.0 52.3 120 120 A A << 0 0 118 -4,-1.1 -3,-0.1 -3,-0.6 -4,-0.0 0.239 360.0 360.0 -99.6 360.0 7.8 5.0 52.9