==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SURFACE ACTIVE PROTEIN 11-OCT-05 2B97 . COMPND 2 MOLECULE: HYDROPHOBIN II; . SOURCE 2 ORGANISM_SCIENTIFIC: HYPOCREA JECORINA; . AUTHOR J.HAKANPAA,M.LINDER,A.POPOV,A.SCHMIDT,J.ROUVINEN . 140 2 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7306.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 64.3 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 . 46 32.9 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 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 14 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 0 2 0 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 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 0 2 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 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 A 0 0 93 0, 0.0 35,-0.2 0, 0.0 34,-0.1 0.000 360.0 360.0 360.0 109.9 1.9 21.8 20.4 2 2 A V - 0 0 27 1,-0.5 66,-0.5 33,-0.1 8,-0.1 0.838 360.0 -12.2-105.0 -78.3 3.9 18.7 19.5 3 3 A a S S- 0 0 32 6,-0.2 -1,-0.5 64,-0.1 6,-0.1 -0.921 73.1-108.5-125.2 155.5 1.6 15.7 19.5 4 4 A P - 0 0 63 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.188 38.1-100.0 -68.9 165.9 -2.0 15.3 20.7 5 5 A T S S+ 0 0 138 2,-0.0 3,-0.4 5,-0.0 2,-0.4 -0.425 85.2 28.8 -74.3 163.7 -2.9 13.4 23.8 6 6 A G S > S- 0 0 57 1,-0.2 3,-0.6 -2,-0.1 0, 0.0 -0.694 118.7 -0.4 94.4-135.3 -4.3 9.9 23.4 7 7 A L T 3 S+ 0 0 108 -2,-0.4 2,-1.0 1,-0.3 3,-0.2 0.903 132.0 44.1 -63.1 -48.5 -3.6 7.4 20.7 8 8 A F T 3 S+ 0 0 31 -3,-0.4 -1,-0.3 1,-0.2 46,-0.2 -0.417 78.0 127.8 -98.0 58.5 -1.2 9.5 18.5 9 9 A S < + 0 0 50 -2,-1.0 -6,-0.2 -3,-0.6 -1,-0.2 0.521 41.1 84.6-101.0 -4.4 0.9 10.8 21.4 10 10 A N E -A 53 0A 34 43,-1.9 43,-2.9 -3,-0.2 2,-0.4 -0.861 66.5-138.1-113.7 121.7 4.5 10.1 20.5 11 11 A P E +A 52 0A 41 0, 0.0 2,-0.3 0, 0.0 41,-0.2 -0.562 33.2 165.4 -77.9 127.7 6.7 12.3 18.3 12 12 A L E -A 51 0A 2 39,-2.8 39,-2.5 -2,-0.4 2,-0.6 -0.940 36.9-128.6-134.7 159.2 8.8 10.3 15.8 13 13 A b E -AB 50 27A 2 14,-2.9 14,-2.9 -2,-0.3 2,-0.4 -0.929 34.8-175.4-109.9 109.1 10.8 11.2 12.7 14 14 A c E -AB 49 26A 0 35,-2.5 35,-3.2 -2,-0.6 12,-0.2 -0.828 31.4-136.0-114.2 143.2 9.8 8.9 9.9 15 15 A A E S+ 0 0 33 10,-1.5 2,-0.4 9,-1.1 10,-0.2 0.884 88.4 18.0 -60.3 -41.0 11.1 8.5 6.4 16 16 A T E - B 0 24A 68 8,-1.6 8,-2.3 33,-0.1 2,-0.6 -0.993 57.1-148.9-135.2 149.4 7.7 8.3 4.8 17 17 A N E - B 0 23A 27 -2,-0.4 2,-0.5 6,-0.2 3,-0.3 -0.972 27.0-160.4-112.6 108.2 4.1 9.0 5.6 18 18 A V E >> - B 0 22A 38 4,-2.8 3,-2.3 -2,-0.6 4,-1.9 -0.841 69.4 -16.2 -95.1 124.3 2.0 6.4 3.7 19 19 A L T 34 S- 0 0 79 -2,-0.5 -1,-0.2 1,-0.3 113,-0.0 0.757 109.8 -80.4 70.8 8.7 -1.6 7.1 3.0 20 20 A D T 34 S+ 0 0 96 -3,-0.3 46,-0.3 2,-0.2 -1,-0.3 0.666 130.2 75.7 63.0 20.6 -1.5 9.9 5.8 21 21 A L T <4 S+ 0 0 52 -3,-2.3 43,-2.0 1,-0.2 2,-0.4 0.512 82.5 52.8-134.7 -19.8 -1.9 7.0 8.1 22 22 A I E < -BC 18 63A 0 -4,-1.9 -4,-2.8 41,-0.3 2,-0.4 -0.992 57.1-150.2-133.7 130.2 1.5 5.1 8.5 23 23 A G E -BC 17 62A 0 39,-3.0 39,-2.4 -2,-0.4 2,-0.4 -0.879 16.7-161.1 -95.2 135.2 5.0 6.1 9.3 24 24 A V E +BC 16 61A 21 -8,-2.3 -8,-1.6 -2,-0.4 -9,-1.1 -0.951 68.7 10.0-116.4 137.7 7.8 4.0 7.8 25 25 A D E S- 0 0 73 35,-2.5 -10,-1.5 -2,-0.4 2,-0.5 0.997 84.2-166.9 59.6 68.0 11.4 4.0 9.1 26 26 A c E -BC 14 59A 3 33,-2.7 33,-1.8 -12,-0.2 2,-0.3 -0.795 9.6-169.8-101.8 124.7 10.6 5.9 12.3 27 27 A K E -B 13 0A 103 -14,-2.9 -14,-2.9 -2,-0.5 3,-0.1 -0.824 24.8-115.6-106.5 147.4 13.4 7.3 14.5 28 28 A T - 0 0 65 -2,-0.3 -16,-0.2 -16,-0.2 29,-0.1 -0.535 41.5-100.7 -73.8 145.7 13.2 8.8 17.9 29 29 A P - 0 0 31 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.378 22.0-146.4 -59.3 148.1 14.1 12.5 18.2 30 30 A T S S+ 0 0 102 2,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.282 81.6 47.2-100.2 8.6 17.7 13.0 19.5 31 31 A I S S- 0 0 81 0, 0.0 2,-0.1 0, 0.0 11,-0.0 -0.917 100.1 -90.9-132.4 159.7 16.7 16.2 21.3 32 32 A A - 0 0 80 -2,-0.3 2,-0.6 1,-0.0 -2,-0.1 -0.501 43.2-138.7 -63.1 145.3 13.8 17.2 23.6 33 33 A V + 0 0 29 -2,-0.1 -31,-0.1 1,-0.1 3,-0.1 -0.938 32.1 165.2-121.0 108.0 11.1 18.5 21.3 34 34 A D + 0 0 120 -2,-0.6 2,-0.3 1,-0.1 -1,-0.1 0.686 59.2 19.7 -97.6 -26.9 9.3 21.6 22.7 35 35 A T S > S- 0 0 60 1,-0.1 4,-2.5 -34,-0.1 5,-0.2 -0.936 74.7-107.4-143.0 162.4 7.4 23.1 19.8 36 36 A G H > S+ 0 0 19 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.884 119.1 52.7 -58.9 -42.3 6.0 22.3 16.4 37 37 A A H > S+ 0 0 70 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.908 110.8 46.7 -66.1 -41.2 8.6 24.3 14.7 38 38 A I H > S+ 0 0 66 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.910 113.0 50.4 -63.1 -44.8 11.4 22.4 16.5 39 39 A F H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.3 0.941 112.9 45.9 -56.7 -50.6 9.8 19.1 15.7 40 40 A Q H X S+ 0 0 80 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.923 116.0 44.9 -59.2 -48.9 9.5 20.0 12.0 41 41 A A H X S+ 0 0 64 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.886 112.3 51.7 -66.6 -39.6 13.1 21.3 11.8 42 42 A H H X S+ 0 0 19 -4,-2.7 4,-0.7 2,-0.2 -2,-0.2 0.961 112.7 44.0 -64.9 -48.3 14.5 18.4 13.7 43 43 A b H ><>S+ 0 0 0 -4,-2.4 5,-2.6 -5,-0.2 3,-1.2 0.924 111.7 53.6 -64.2 -39.3 12.9 15.7 11.6 44 44 A A H ><5S+ 0 0 66 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.867 101.5 59.6 -61.9 -35.2 13.8 17.6 8.4 45 45 A S H 3<5S+ 0 0 82 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.700 107.4 48.3 -63.6 -21.5 17.4 17.6 9.5 46 46 A K T <<5S- 0 0 107 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.065 120.7-109.8-102.7 17.7 17.1 13.8 9.5 47 47 A G T < 5S+ 0 0 66 -3,-2.0 -3,-0.2 1,-0.2 2,-0.2 0.786 83.7 115.2 64.3 23.7 15.5 13.7 6.0 48 48 A S < - 0 0 10 -5,-2.6 -33,-0.2 -6,-0.1 -1,-0.2 -0.695 67.6-109.6-131.0 171.7 12.2 12.7 7.7 49 49 A K E -A 14 0A 107 -35,-3.2 -35,-2.5 -2,-0.2 2,-0.7 -0.844 31.1-119.3-105.5 140.9 8.7 13.7 8.4 50 50 A P E +A 13 0A 14 0, 0.0 17,-2.2 0, 0.0 2,-0.3 -0.692 44.9 172.1 -83.8 113.6 7.4 14.7 11.9 51 51 A L E -AD 12 66A 2 -39,-2.5 -39,-2.8 -2,-0.7 2,-0.6 -0.900 33.7-135.3-124.1 152.7 4.7 12.2 12.7 52 52 A a E -AD 11 65A 2 13,-3.1 13,-2.5 -2,-0.3 2,-0.2 -0.938 38.4-173.5-109.9 114.5 2.7 11.6 15.9 53 53 A d E -AD 10 64A 0 -43,-2.9 -43,-1.9 -2,-0.6 -44,-0.3 -0.654 38.6-112.0-121.2 166.6 2.6 7.8 16.4 54 54 A V S S+ 0 0 53 9,-2.1 10,-0.1 -2,-0.2 -45,-0.1 0.574 99.7 35.4 -75.6 -10.1 1.0 5.1 18.5 55 55 A A - 0 0 29 8,-0.2 -2,-0.2 -45,-0.2 -45,-0.1 -0.959 69.8-136.0-143.3 159.8 4.3 4.1 20.2 56 56 A P S S+ 0 0 80 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.358 71.5 85.7-103.9 8.0 7.5 5.9 21.3 57 57 A V S S- 0 0 86 1,-0.1 -2,-0.1 -29,-0.1 -31,-0.1 -0.620 88.0 -85.8-110.1 161.0 10.3 3.7 20.1 58 58 A A + 0 0 66 -2,-0.2 2,-0.3 -33,-0.0 -31,-0.2 -0.388 60.5 163.6 -61.0 142.1 12.2 3.4 16.8 59 59 A D E -C 26 0A 78 -33,-1.8 -33,-2.7 1,-0.1 3,-0.2 -0.996 49.8-119.2-161.1 159.6 10.3 1.0 14.5 60 60 A Q E S- 0 0 111 -2,-0.3 -35,-2.5 1,-0.3 2,-0.3 0.893 97.7 -2.2 -65.7 -47.7 9.9 -0.2 10.9 61 61 A A E +C 24 0A 24 -37,-0.2 2,-0.3 -36,-0.1 -1,-0.3 -0.961 68.2 172.6-156.5 134.3 6.2 0.9 10.5 62 62 A L E -C 23 0A 15 -39,-2.4 -39,-3.0 -2,-0.3 2,-0.4 -0.985 40.8-102.8-139.8 149.4 3.7 2.5 12.9 63 63 A L E +C 22 0A 19 -2,-0.3 -9,-2.1 -41,-0.2 2,-0.3 -0.618 59.5 160.1 -70.9 129.6 0.2 3.9 12.7 64 64 A d E -D 53 0A 1 -43,-2.0 2,-0.3 -2,-0.4 -11,-0.2 -0.946 36.6-141.7-147.0 162.3 0.8 7.7 12.8 65 65 A Q E -D 52 0A 91 -13,-2.5 -13,-3.1 -2,-0.3 -44,-0.1 -0.969 38.8 -99.3-122.9 149.9 -0.8 11.1 12.0 66 66 A K E -D 51 0A 93 -2,-0.3 -15,-0.2 -46,-0.3 3,-0.1 -0.319 45.9 -98.6 -62.2 146.6 1.1 14.0 10.5 67 67 A A > - 0 0 5 -17,-2.2 3,-1.6 1,-0.1 -1,-0.1 -0.298 59.3 -80.1 -59.5 149.5 2.2 16.7 13.0 68 68 A I T 3 S+ 0 0 113 -66,-0.5 -1,-0.1 1,-0.3 -3,-0.0 -0.143 113.8 16.7 -59.3 146.5 -0.3 19.6 13.0 69 69 A G T 3 0 0 82 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.659 360.0 360.0 60.3 20.0 -0.0 22.1 10.3 70 70 A T < 0 0 70 -3,-1.6 -1,-0.3 -4,-0.1 -4,-0.1 -0.664 360.0 360.0-110.7 360.0 2.1 19.9 8.1 71 !* 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 72 1 B A 0 0 136 0, 0.0 35,-0.2 0, 0.0 33,-0.1 0.000 360.0 360.0 360.0 9.8 -16.0 -16.3 14.4 73 2 B V + 0 0 14 1,-0.2 66,-0.4 31,-0.2 8,-0.1 0.845 360.0 30.1 -96.1 -55.8 -14.3 -14.6 11.5 74 3 B e S S- 0 0 24 6,-0.2 -1,-0.2 64,-0.1 6,-0.1 -0.880 85.8-115.3-107.3 150.6 -13.3 -11.2 13.0 75 4 B P - 0 0 63 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.176 33.0 -98.9 -72.0 168.3 -12.5 -10.5 16.7 76 5 B T S S+ 0 0 139 2,-0.0 3,-0.5 5,-0.0 2,-0.3 -0.402 87.5 31.8 -74.8 166.9 -14.6 -8.4 19.0 77 6 B G S > S- 0 0 56 1,-0.2 3,-0.7 -2,-0.1 0, 0.0 -0.614 120.2 -2.5 87.9-140.6 -13.4 -4.8 19.7 78 7 B L T 3 S+ 0 0 109 -2,-0.3 2,-1.0 1,-0.3 3,-0.3 0.895 132.1 45.9 -57.3 -50.6 -11.6 -2.6 17.2 79 8 B F T 3 S+ 0 0 34 -3,-0.5 -1,-0.3 1,-0.2 46,-0.2 -0.355 74.7 126.0 -95.6 57.8 -11.2 -5.0 14.3 80 9 B S < + 0 0 51 -2,-1.0 -6,-0.2 -3,-0.7 -1,-0.2 0.546 45.2 82.7 -94.8 -8.0 -14.8 -6.4 14.3 81 10 B N E -E 124 0B 33 43,-1.8 43,-3.0 -3,-0.3 2,-0.3 -0.867 66.5-139.9-112.5 118.7 -16.0 -5.8 10.7 82 11 B P E +E 123 0B 42 0, 0.0 2,-0.3 0, 0.0 41,-0.2 -0.551 31.7 168.9 -74.8 130.4 -15.2 -8.2 7.8 83 12 B L E -E 122 0B 0 39,-2.8 39,-2.5 -2,-0.3 2,-0.5 -0.929 34.8-129.1-133.6 159.5 -14.4 -6.3 4.5 84 13 B f E -EF 121 98B 4 14,-2.9 14,-2.7 -2,-0.3 2,-0.3 -0.965 36.4-176.5-109.2 119.2 -13.0 -7.3 1.1 85 14 B g E -EF 120 97B 0 35,-2.9 35,-2.5 -2,-0.5 12,-0.2 -0.825 35.2-131.3-120.7 155.0 -10.1 -4.9 0.2 86 15 B A E S+ 0 0 40 9,-1.7 2,-0.3 10,-1.1 10,-0.2 0.901 89.3 1.3 -69.0 -41.1 -7.9 -4.5 -2.8 87 16 B T E - F 0 95B 50 8,-1.3 8,-2.6 33,-0.1 2,-0.6 -0.994 56.8-137.4-148.2 149.6 -4.6 -4.4 -0.8 88 17 B N E - F 0 94B 44 -2,-0.3 2,-0.6 6,-0.2 6,-0.2 -0.966 29.4-153.5-105.2 111.1 -3.3 -4.7 2.8 89 18 B V E >> - F 0 93B 30 4,-3.3 3,-2.3 -2,-0.6 4,-2.1 -0.823 65.2 -26.9 -94.6 119.1 -0.6 -2.1 3.2 90 19 B L T 34 S- 0 0 75 -2,-0.6 -1,-0.2 1,-0.3 -29,-0.0 0.776 110.0 -70.7 56.7 33.6 2.1 -2.6 5.9 91 20 B D T 34 S+ 0 0 103 -3,-0.2 -1,-0.3 2,-0.1 46,-0.2 0.698 131.3 72.0 59.1 22.7 -0.2 -4.9 8.0 92 21 B L T <4 S+ 0 0 35 -3,-2.3 43,-2.6 1,-0.2 2,-0.5 0.666 83.0 48.6-132.0 -48.8 -2.1 -1.8 8.9 93 22 B I E < -FG 89 134B 1 -4,-2.1 -4,-3.3 41,-0.2 2,-0.5 -0.955 56.5-148.9-121.2 124.0 -4.3 -0.2 6.2 94 23 B G E -FG 88 133B 0 39,-2.9 39,-2.4 -2,-0.5 2,-0.5 -0.767 20.3-149.1 -82.5 126.6 -6.9 -1.8 3.8 95 24 B V E S+FG 87 132B 36 -8,-2.6 -9,-1.7 -2,-0.5 -8,-1.3 -0.874 71.4 0.0-100.6 131.6 -7.0 0.0 0.5 96 25 B D E S- 0 0 68 35,-1.9 -10,-1.1 -2,-0.5 2,-0.4 0.984 83.4-173.0 55.3 68.9 -10.3 0.2 -1.5 97 26 B g E -FG 85 130B 0 33,-2.9 33,-1.7 -3,-0.3 2,-0.3 -0.770 9.2-179.5 -95.0 140.1 -12.4 -1.9 0.9 98 27 B K E -F 84 0B 134 -14,-2.7 -14,-2.9 -2,-0.4 30,-0.1 -0.914 32.1 -98.1-133.1 155.6 -16.0 -2.9 0.1 99 28 B T - 0 0 64 -2,-0.3 -16,-0.2 -16,-0.2 30,-0.0 -0.473 39.3-105.5 -74.0 147.4 -18.5 -4.9 2.1 100 29 B P - 0 0 24 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.418 20.1-144.7 -57.7 148.4 -19.0 -8.6 1.6 101 30 B T S S+ 0 0 102 2,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.290 82.1 44.4-102.6 9.9 -22.3 -9.3 -0.3 102 31 B I S S- 0 0 84 0, 0.0 2,-0.3 0, 0.0 11,-0.0 -0.923 96.1 -97.4-135.1 161.2 -22.9 -12.5 1.7 103 32 B A - 0 0 83 -2,-0.3 2,-0.7 1,-0.0 -2,-0.1 -0.633 39.3-141.6 -68.7 136.8 -22.7 -13.4 5.3 104 33 B V - 0 0 20 -2,-0.3 -31,-0.2 1,-0.1 6,-0.1 -0.908 20.3-178.1-111.7 109.9 -19.3 -15.1 5.8 105 34 B D + 0 0 118 -2,-0.7 2,-0.3 -33,-0.1 -1,-0.1 0.718 64.6 16.3 -79.8 -28.8 -19.5 -18.0 8.2 106 35 B T S > S- 0 0 65 1,-0.1 4,-2.4 -33,-0.0 5,-0.2 -0.938 79.6-104.5-139.0 165.1 -15.9 -19.1 8.3 107 36 B G H > S+ 0 0 14 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.898 120.2 51.5 -59.7 -40.2 -12.5 -17.8 7.4 108 37 B A H > S+ 0 0 70 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.917 111.4 48.4 -65.7 -39.7 -12.3 -20.1 4.3 109 38 B I H > S+ 0 0 65 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.892 111.8 49.8 -61.8 -47.4 -15.7 -18.8 3.1 110 39 B F H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.945 112.4 47.0 -59.1 -49.2 -14.6 -15.2 3.8 111 40 B Q H X S+ 0 0 71 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.924 113.7 47.7 -54.7 -49.4 -11.4 -15.7 1.8 112 41 B A H X S+ 0 0 62 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.903 111.3 50.8 -60.3 -40.3 -13.2 -17.4 -1.1 113 42 B H H X S+ 0 0 19 -4,-2.5 4,-0.7 -5,-0.2 -2,-0.2 0.976 112.9 44.3 -65.4 -49.6 -15.9 -14.7 -1.3 114 43 B f H ><>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 3,-1.3 0.924 112.2 53.2 -61.1 -42.3 -13.3 -11.8 -1.4 115 44 B A H ><5S+ 0 0 52 -4,-2.8 3,-1.8 -5,-0.2 -1,-0.2 0.887 102.1 57.4 -61.0 -31.5 -11.2 -13.6 -3.9 116 45 B S H 3<5S+ 0 0 91 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.742 107.7 50.0 -71.8 -13.2 -14.2 -14.1 -6.2 117 46 B K T <<5S- 0 0 89 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.174 124.7-101.9 -99.5 -0.5 -14.5 -10.2 -6.1 118 47 B G T < 5S+ 0 0 69 -3,-1.8 -3,-0.2 1,-0.2 2,-0.2 0.695 88.7 103.4 82.7 22.4 -10.8 -9.6 -7.0 119 48 B S < - 0 0 27 -5,-2.6 -1,-0.2 -6,-0.2 -33,-0.2 -0.602 65.7-114.0-137.6-178.7 -10.0 -8.8 -3.3 120 49 B K E -E 85 0B 110 -35,-2.5 -35,-2.9 -2,-0.2 2,-0.4 -0.950 31.1-113.0-127.5 142.1 -8.6 -9.9 0.0 121 50 B P E +E 84 0B 7 0, 0.0 17,-0.9 0, 0.0 2,-0.3 -0.584 41.3 164.2 -80.7 128.7 -10.3 -10.5 3.4 122 51 B L E -EH 83 137B 5 -39,-2.5 -39,-2.8 -2,-0.4 2,-0.6 -0.969 36.5-129.9-137.7 153.9 -9.5 -8.1 6.3 123 52 B e E -EH 82 136B 1 13,-2.9 13,-2.2 -2,-0.3 2,-0.2 -0.938 42.2-177.8-104.9 121.6 -11.1 -7.3 9.6 124 53 B h E -EH 81 135B 0 -43,-3.0 -43,-1.8 -2,-0.6 11,-0.2 -0.676 41.0-107.9-128.5 171.0 -11.5 -3.5 9.8 125 54 B V S S+ 0 0 52 9,-2.4 10,-0.1 -2,-0.2 -45,-0.1 0.604 99.5 36.9 -77.6 -12.7 -12.6 -0.6 12.0 126 55 B A - 0 0 25 8,-0.2 -2,-0.1 -45,-0.2 2,-0.1 -0.987 67.8-137.1-139.9 151.8 -15.8 0.2 10.1 127 56 B P S S+ 0 0 82 0, 0.0 2,-0.3 0, 0.0 -28,-0.1 -0.159 77.9 82.3 -99.2 34.9 -18.5 -1.9 8.2 128 57 B V S S- 0 0 86 -47,-0.1 -2,-0.1 -30,-0.1 -31,-0.1 -0.944 91.5 -83.6-132.3 159.9 -18.8 0.4 5.2 129 58 B A + 0 0 63 -2,-0.3 2,-0.3 -33,-0.1 -31,-0.2 -0.311 53.8 169.3 -61.6 144.0 -16.8 0.8 2.0 130 59 B D E -G 97 0B 63 -33,-1.7 -33,-2.9 1,-0.1 3,-0.3 -0.963 39.7-135.5-159.6 140.5 -13.7 3.1 2.5 131 60 B Q E S+ 0 0 122 -2,-0.3 -35,-1.9 -35,-0.2 2,-0.2 0.735 99.4 13.4 -71.1 -24.1 -10.7 3.9 0.4 132 61 B A E S+G 95 0B 30 -37,-0.2 2,-0.3 -36,-0.1 -1,-0.2 -0.717 79.5 167.6-157.3 91.4 -8.2 3.6 3.2 133 62 B L E -G 94 0B 10 -39,-2.4 -39,-2.9 -3,-0.3 2,-0.3 -0.872 42.2-105.8-113.6 148.4 -9.3 1.9 6.5 134 63 B L E +G 93 0B 37 -2,-0.3 -9,-2.4 -41,-0.2 2,-0.3 -0.551 57.8 160.2 -70.5 126.4 -7.5 0.7 9.6 135 64 B h E -H 124 0B 1 -43,-2.6 2,-0.3 -2,-0.3 -11,-0.2 -0.882 33.5-145.7-144.9 170.0 -7.6 -3.1 9.3 136 65 B Q E -H 123 0B 79 -13,-2.2 -13,-2.9 -2,-0.3 -44,-0.1 -0.994 38.7 -92.6-141.3 142.7 -6.0 -6.4 10.5 137 66 B K E -H 122 0B 122 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.307 43.7-114.7 -53.6 136.1 -5.5 -9.7 8.6 138 67 B A > - 0 0 4 -17,-0.9 3,-0.9 1,-0.1 -64,-0.1 -0.657 31.9-116.3 -72.1 130.0 -8.3 -12.1 9.1 139 68 B I T 3 S+ 0 0 133 -2,-0.4 -1,-0.1 -66,-0.4 -3,-0.0 -0.308 91.8 11.6 -71.4 147.0 -7.2 -15.2 11.0 140 69 B G T 3 0 0 70 1,-0.2 -1,-0.2 -33,-0.1 -29,-0.2 0.818 360.0 360.0 48.8 43.6 -7.4 -18.5 9.1 141 70 B T < 0 0 65 -3,-0.9 -1,-0.2 -20,-0.1 -33,-0.1 -0.929 360.0 360.0-110.2 360.0 -8.0 -17.0 5.8