==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 30-SEP-11 4A35 . COMPND 2 MOLECULE: MITOCHONDRIAL ENOLASE SUPERFAMILY MEMBER 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.R.C.MUNIZ,D.S.FROESE,T.KROJER,M.VOLLMAR,P.CANNING,F.VON DE . 441 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17220.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 300 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 7.0 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 . 2 0.5 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 . 20 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 34.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.0 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 2 1 2 0 2 1 4 0 1 1 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 2 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 0 PARALLEL BRIDGES PER LADDER . 3 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 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 4 A S 0 0 134 0, 0.0 130,-0.0 0, 0.0 129,-0.0 0.000 360.0 360.0 360.0 141.3 77.9 8.0 -10.5 2 5 A M + 0 0 107 125,-0.1 2,-0.2 2,-0.0 130,-0.1 0.143 360.0 134.1-102.6 13.3 74.4 7.1 -9.2 3 6 A V + 0 0 22 128,-0.1 2,-0.3 79,-0.1 124,-0.1 -0.490 24.3 148.1 -75.1 132.9 72.7 8.5 -12.4 4 7 A R + 0 0 94 -2,-0.2 42,-0.2 79,-0.0 -2,-0.0 -0.970 18.7 58.0-156.7 163.0 70.0 6.3 -13.9 5 8 A G - 0 0 19 -2,-0.3 77,-2.5 40,-0.1 2,-0.4 0.114 63.1 -97.1 95.2 151.8 66.8 6.5 -15.8 6 9 A R B -A 81 0A 107 75,-0.3 39,-1.6 76,-0.1 2,-0.3 -0.919 42.0-112.6-102.4 130.8 65.2 7.8 -19.0 7 10 A I E +B 44 0B 0 73,-3.2 72,-2.3 -2,-0.4 37,-0.3 -0.537 45.8 168.5 -67.5 118.1 63.4 11.2 -18.9 8 11 A S E + 0 0 37 35,-2.4 2,-0.3 -2,-0.3 36,-0.2 0.686 52.5 27.2-108.7 -29.6 59.8 10.0 -19.5 9 12 A R E -B 43 0B 123 34,-1.2 34,-2.1 2,-0.0 2,-0.3 -0.985 51.3-172.9-139.6 149.8 57.6 13.1 -18.6 10 13 A L E -B 42 0B 33 -2,-0.3 2,-0.3 32,-0.2 32,-0.2 -0.988 6.5-178.4-139.7 134.6 57.8 16.9 -18.5 11 14 A S E -B 41 0B 48 30,-2.4 30,-2.4 -2,-0.3 2,-0.4 -0.953 3.5-171.1-128.3 149.0 55.2 19.3 -17.2 12 15 A V E -B 40 0B 20 -2,-0.3 2,-0.3 28,-0.2 28,-0.2 -0.983 6.6-173.3-142.6 132.1 55.4 23.1 -17.2 13 16 A R E -B 39 0B 36 26,-2.2 26,-2.9 -2,-0.4 2,-0.7 -0.951 28.0-123.6-131.7 146.9 53.0 25.4 -15.4 14 17 A D E -B 38 0B 14 -2,-0.3 415,-2.8 415,-0.3 2,-0.5 -0.804 35.0-176.2 -88.5 107.1 52.4 29.1 -15.2 15 18 A V E -BC 37 428B 0 22,-2.7 22,-2.7 -2,-0.7 2,-0.4 -0.959 1.8-177.6-113.6 125.5 52.6 30.1 -11.5 16 19 A R E -B 36 0B 16 411,-2.8 20,-0.2 -2,-0.5 19,-0.1 -0.987 16.7-158.2-133.6 133.5 51.9 33.7 -10.4 17 20 A F - 0 0 3 18,-2.6 2,-2.2 -2,-0.4 3,-0.3 -0.924 23.1-131.9-105.3 135.4 52.0 35.5 -7.1 18 21 A P > + 0 0 34 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.209 51.5 145.8 -82.2 55.4 50.0 38.7 -6.7 19 22 A T G >>> + 0 0 16 -2,-2.2 3,-1.3 1,-0.3 4,-0.8 0.796 60.9 70.8 -67.6 -20.5 52.9 40.7 -5.2 20 23 A S G 345S+ 0 0 45 -3,-0.3 -1,-0.3 1,-0.3 3,-0.2 0.782 98.5 51.1 -64.8 -24.9 51.7 43.9 -6.9 21 24 A L G <45S+ 0 0 129 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.603 100.3 64.6 -86.4 -12.3 48.7 43.9 -4.5 22 25 A G T <45S- 0 0 50 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.709 103.2-125.8 -83.4 -23.2 51.1 43.5 -1.4 23 26 A G T <5S+ 0 0 50 -4,-0.8 3,-0.2 1,-0.4 2,-0.2 0.342 75.6 100.3 94.2 -8.0 52.7 46.9 -1.9 24 27 A H < + 0 0 83 -5,-0.6 -1,-0.4 1,-0.1 -2,-0.2 -0.667 58.5 47.3-103.7 168.4 56.3 45.6 -2.0 25 28 A G + 0 0 1 1,-0.3 2,-0.2 -2,-0.2 -1,-0.1 0.319 67.7 139.7 87.4 -2.4 58.6 45.0 -5.1 26 29 A A + 0 0 18 172,-0.3 172,-2.2 -3,-0.2 -1,-0.3 -0.518 23.3 174.9 -75.7 136.3 58.1 48.2 -7.0 27 30 A D - 0 0 12 3,-2.7 198,-0.1 -2,-0.2 225,-0.1 -0.684 48.5 -92.0-125.8-177.7 61.2 49.7 -8.6 28 31 A A S S+ 0 0 3 196,-0.4 3,-0.2 -2,-0.2 197,-0.1 0.711 125.1 29.8 -67.7 -25.9 61.6 52.8 -10.9 29 32 A M S S+ 0 0 73 1,-0.2 2,-0.8 2,-0.0 -1,-0.1 0.818 124.5 42.3 -98.2 -50.7 61.2 50.6 -14.1 30 33 A H + 0 0 44 1,-0.1 -3,-2.7 -5,-0.1 -1,-0.2 -0.888 68.0 170.3-100.9 90.7 58.9 47.7 -13.0 31 34 A T S S+ 0 0 95 -2,-0.8 -5,-0.1 -5,-0.2 -1,-0.1 0.519 71.8 24.6 -85.4 -9.7 56.3 49.6 -10.9 32 35 A D S S+ 0 0 101 -7,-0.1 -12,-0.2 -6,-0.0 -1,-0.2 -0.225 77.3 173.3-150.1 52.1 53.7 46.8 -10.4 33 36 A P - 0 0 4 0, 0.0 2,-0.6 0, 0.0 27,-0.2 -0.388 23.9-156.1 -74.1 148.9 55.4 43.3 -10.7 34 37 A D - 0 0 36 25,-2.4 24,-0.1 -15,-0.2 2,-0.1 -0.939 30.0-129.9-114.2 96.4 53.5 40.0 -9.9 35 38 A Y + 0 0 14 -2,-0.6 -18,-2.6 -19,-0.1 2,-0.3 -0.303 45.1 161.6 -52.9 123.3 56.5 37.7 -9.1 36 39 A S E -BD 16 58B 0 22,-2.7 22,-2.6 -20,-0.2 324,-0.3 -0.870 25.2-157.0-141.6 170.8 55.9 34.6 -11.2 37 40 A A E -BD 15 57B 0 -22,-2.7 -22,-2.7 -2,-0.3 2,-0.7 -0.998 26.0-128.3-153.5 148.5 57.6 31.5 -12.6 38 41 A A E -BD 14 56B 0 18,-1.6 18,-0.8 -2,-0.3 2,-0.6 -0.902 40.6-153.4 -87.9 112.4 57.4 28.9 -15.3 39 42 A Y E -BD 13 55B 2 -26,-2.9 -26,-2.2 -2,-0.7 2,-0.4 -0.897 10.7-165.7-101.4 119.1 57.6 25.8 -13.1 40 43 A V E -BD 12 54B 0 14,-3.4 14,-3.0 -2,-0.6 2,-0.4 -0.870 9.0-174.9-106.3 136.4 59.0 22.7 -14.7 41 44 A V E -BD 11 53B 10 -30,-2.4 -30,-2.4 -2,-0.4 2,-0.4 -0.992 4.5-172.6-129.5 126.1 58.9 19.1 -13.4 42 45 A I E -BD 10 52B 1 10,-3.1 10,-2.6 -2,-0.4 2,-0.3 -0.943 3.8-164.7-117.1 145.0 60.6 16.2 -15.2 43 46 A E E -B 9 0B 52 -34,-2.1 -35,-2.4 -2,-0.4 -34,-1.2 -0.844 5.0-149.4-123.4 157.5 60.3 12.6 -14.3 44 47 A T E -B 7 0B 8 6,-0.5 3,-0.5 -2,-0.3 -37,-0.2 -0.752 28.3-118.0-115.6 174.2 62.3 9.5 -15.2 45 48 A D S S+ 0 0 81 -39,-1.6 -40,-0.1 -2,-0.3 -38,-0.1 0.187 86.5 106.6 -93.6 15.5 61.3 5.8 -15.6 46 49 A A S S- 0 0 33 -42,-0.2 -1,-0.2 4,-0.2 -41,-0.1 0.647 75.7-141.1 -69.0 -18.9 63.7 4.9 -12.6 47 50 A E + 0 0 191 -3,-0.5 -2,-0.1 3,-0.1 -1,-0.1 0.825 69.7 116.4 57.0 36.8 60.7 4.3 -10.2 48 51 A D S S- 0 0 53 2,-0.2 3,-0.1 -4,-0.1 -1,-0.1 0.314 82.8-121.3-109.4 -0.7 62.7 6.0 -7.3 49 52 A G + 0 0 66 1,-0.2 2,-0.5 -5,-0.1 -2,-0.0 0.497 66.4 140.1 67.1 10.2 60.2 8.9 -6.9 50 53 A I - 0 0 52 80,-0.0 -6,-0.5 2,-0.0 2,-0.3 -0.731 29.5-174.9 -88.8 125.2 63.0 11.4 -7.7 51 54 A K - 0 0 90 -2,-0.5 2,-0.6 -8,-0.1 -8,-0.2 -0.880 24.1-128.4-120.0 147.6 61.8 14.4 -9.8 52 55 A G E -D 42 0B 0 -10,-2.6 -10,-3.1 -2,-0.3 2,-0.4 -0.875 26.2-166.4 -94.1 121.8 63.7 17.2 -11.4 53 56 A C E +D 41 0B 2 -2,-0.6 2,-0.3 -12,-0.2 72,-0.3 -0.905 9.2 177.3-109.2 141.7 62.1 20.6 -10.6 54 57 A G E -D 40 0B 0 -14,-3.0 -14,-3.4 -2,-0.4 2,-0.3 -0.979 7.0-173.1-144.1 152.6 63.1 23.8 -12.5 55 58 A I E -D 39 0B 0 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.948 13.4-167.1-138.6 160.2 62.1 27.4 -12.6 56 59 A T E -D 38 0B 0 -18,-0.8 -18,-1.6 -2,-0.3 2,-0.3 -0.950 30.8-124.7-139.3 143.6 62.6 30.7 -14.4 57 60 A F E +D 37 0B 33 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.731 32.3 165.3 -99.8 139.0 61.4 34.0 -12.9 58 61 A T E -D 36 0B 17 -22,-2.6 -22,-2.7 -2,-0.3 302,-0.1 -0.860 43.4-116.6-136.2 176.4 59.1 36.6 -14.5 59 62 A L - 0 0 63 2,-0.3 -25,-2.4 -2,-0.3 2,-0.6 0.200 66.1 -91.8-104.0 16.8 57.0 39.6 -13.5 60 63 A G S > S+ 0 0 1 -27,-0.2 3,-2.1 -45,-0.1 4,-0.2 -0.856 103.7 71.3 117.6 -95.7 53.6 38.1 -14.3 61 64 A K T 3 S+ 0 0 181 -2,-0.6 -2,-0.3 1,-0.2 -1,-0.1 -0.328 100.4 36.1 -58.2 136.2 52.5 38.9 -17.9 62 65 A G T >> S+ 0 0 26 -4,-0.1 4,-1.7 -3,-0.1 3,-0.6 0.150 80.5 108.4 102.7 -11.2 54.6 36.9 -20.3 63 66 A T H <> S+ 0 0 0 -3,-2.1 4,-2.5 1,-0.3 5,-0.1 0.892 77.9 56.3 -61.8 -38.2 54.9 33.8 -18.1 64 67 A E H 3> S+ 0 0 96 -4,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.796 104.2 53.7 -61.7 -31.9 52.5 32.0 -20.6 65 68 A V H <> S+ 0 0 70 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.907 109.5 47.2 -67.8 -43.2 55.1 32.9 -23.5 66 69 A V H X S+ 0 0 3 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.936 109.9 53.1 -60.1 -49.3 57.9 31.3 -21.5 67 70 A V H X S+ 0 0 21 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.934 108.3 52.0 -52.3 -46.4 55.6 28.2 -20.8 68 71 A C H X S+ 0 0 86 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.897 110.3 47.0 -56.2 -43.9 55.1 28.0 -24.7 69 72 A A H X S+ 0 0 9 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.856 107.6 55.6 -72.7 -32.4 58.9 28.1 -25.3 70 73 A V H >X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 3,-0.5 0.950 107.8 50.6 -61.3 -46.8 59.5 25.4 -22.6 71 74 A N H 3< S+ 0 0 97 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.867 107.8 53.7 -56.9 -37.1 56.9 23.2 -24.6 72 75 A A H 3< S+ 0 0 40 -4,-1.7 3,-0.2 1,-0.2 -1,-0.2 0.804 114.1 41.4 -67.2 -31.5 59.0 24.0 -27.8 73 76 A L H X< S+ 0 0 0 -4,-1.5 3,-2.0 -3,-0.5 4,-0.4 0.674 90.4 90.4 -87.5 -20.6 62.2 22.7 -26.1 74 77 A A G >X S+ 0 0 9 -4,-1.6 4,-2.3 1,-0.3 3,-1.6 0.782 75.3 64.4 -48.8 -40.2 60.6 19.7 -24.4 75 78 A H G 34 S+ 0 0 108 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.762 96.1 61.9 -59.9 -24.7 61.3 17.2 -27.3 76 79 A H G <4 S+ 0 0 14 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.745 114.6 31.4 -70.0 -26.5 65.1 17.7 -26.6 77 80 A V T X4 S+ 0 0 0 -3,-1.6 3,-1.3 -4,-0.4 -70,-0.3 0.737 98.6 96.2-104.5 -27.0 64.9 16.3 -23.0 78 81 A L T 3< S+ 0 0 46 -4,-2.3 -70,-0.2 1,-0.2 3,-0.1 -0.352 94.4 10.8 -68.9 138.8 62.0 13.8 -23.4 79 82 A N T 3 S+ 0 0 109 -72,-2.3 2,-0.4 1,-0.2 -1,-0.2 0.641 97.7 130.4 67.0 21.5 63.1 10.1 -24.0 80 83 A K < - 0 0 85 -3,-1.3 -73,-3.2 -73,-0.3 2,-0.3 -0.859 62.8-120.5-104.0 138.7 66.7 10.9 -23.2 81 84 A D B >> -A 6 0A 48 -2,-0.4 4,-1.2 -75,-0.3 3,-0.7 -0.614 18.0-137.6 -72.4 129.9 68.8 8.8 -20.7 82 85 A L H 3> S+ 0 0 0 -77,-2.5 4,-2.6 -2,-0.3 3,-0.3 0.859 104.4 61.1 -58.6 -33.7 70.0 11.2 -17.9 83 86 A K H 3> S+ 0 0 69 -78,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.867 103.7 50.2 -57.7 -39.0 73.5 9.5 -18.1 84 87 A D H <4 S+ 0 0 111 -3,-0.7 4,-0.3 2,-0.2 -1,-0.2 0.771 112.8 46.0 -71.0 -34.9 73.7 10.7 -21.8 85 88 A I H >< S+ 0 0 4 -4,-1.2 3,-1.4 -3,-0.3 7,-0.3 0.969 118.3 39.3 -70.5 -59.1 72.8 14.3 -20.9 86 89 A V H >< S+ 0 0 8 -4,-2.6 3,-0.6 1,-0.3 -2,-0.2 0.743 111.0 61.9 -67.9 -23.5 75.1 14.7 -17.8 87 90 A G T 3< S+ 0 0 54 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.632 123.7 17.5 -75.0 -20.7 77.8 12.7 -19.7 88 91 A D T <> S+ 0 0 91 -3,-1.4 4,-2.0 -4,-0.3 -1,-0.3 -0.509 74.6 158.6-148.5 68.5 78.0 15.4 -22.5 89 92 A F H <> S+ 0 0 0 -3,-0.6 4,-3.0 1,-0.2 61,-0.2 0.887 74.9 57.4 -69.6 -32.8 76.3 18.4 -20.8 90 93 A R H > S+ 0 0 60 59,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.917 107.3 48.7 -57.3 -48.2 78.1 20.8 -23.2 91 94 A G H > S+ 0 0 27 58,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.909 113.0 46.2 -58.4 -46.5 76.4 18.9 -26.2 92 95 A F H X S+ 0 0 21 -4,-2.0 4,-2.3 -7,-0.3 -2,-0.2 0.922 111.6 52.4 -64.8 -42.9 73.0 19.0 -24.6 93 96 A Y H X S+ 0 0 2 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.938 109.5 49.6 -55.4 -48.1 73.5 22.7 -23.8 94 97 A R H X S+ 0 0 87 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.860 108.6 52.9 -62.1 -37.3 74.4 23.4 -27.5 95 98 A Q H < S+ 0 0 93 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.936 114.1 41.8 -68.1 -39.3 71.2 21.5 -28.7 96 99 A L H < S+ 0 0 2 -4,-2.3 3,-0.4 1,-0.2 -2,-0.2 0.867 125.4 34.2 -68.4 -43.3 68.9 23.6 -26.5 97 100 A T H < S+ 0 0 7 -4,-2.4 11,-0.3 -5,-0.2 -2,-0.2 0.569 126.3 37.7 -93.4 -18.1 70.6 27.0 -27.1 98 101 A S S < S+ 0 0 25 -4,-2.2 -1,-0.2 -5,-0.2 2,-0.2 -0.187 71.8 158.3-126.7 40.3 71.7 26.5 -30.8 99 102 A D > - 0 0 20 -3,-0.4 4,-2.5 1,-0.1 5,-0.3 -0.503 51.6-121.7 -61.0 126.5 68.6 24.5 -32.2 100 103 A G T 4 S+ 0 0 70 1,-0.2 -1,-0.1 -2,-0.2 4,-0.1 0.741 105.9 20.6 -50.3 -26.5 68.9 25.2 -36.0 101 104 A Q T >4 S+ 0 0 170 2,-0.1 3,-1.4 3,-0.0 4,-0.3 0.823 123.2 51.6-106.8 -48.6 65.4 26.7 -36.0 102 105 A L G >4 S+ 0 0 33 1,-0.3 3,-1.6 2,-0.2 4,-0.2 0.781 96.2 70.1 -63.7 -26.5 64.6 27.8 -32.4 103 106 A R G >< S+ 0 0 70 -4,-2.5 3,-2.0 1,-0.3 -1,-0.3 0.819 85.8 70.0 -63.4 -22.7 67.9 29.7 -32.0 104 107 A W G < S+ 0 0 223 -3,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.817 90.8 59.4 -61.8 -30.5 66.4 32.3 -34.5 105 108 A I G < S- 0 0 112 -3,-1.6 7,-0.3 -4,-0.3 -1,-0.3 0.509 133.9 -17.4 -82.3 2.2 63.9 33.4 -31.8 106 109 A G < - 0 0 17 -3,-2.0 -2,-0.1 -4,-0.2 -3,-0.1 0.328 57.0-140.6-117.5-100.7 66.9 34.3 -29.6 107 110 A P S S- 0 0 43 0, 0.0 -4,-0.1 0, 0.0 -9,-0.1 0.465 88.7 -33.9 -77.8 141.4 69.7 33.3 -30.0 108 111 A E S S+ 0 0 9 -11,-0.3 2,-0.3 1,-0.1 226,-0.1 0.876 121.3 90.1 49.8 47.8 70.5 32.8 -26.3 109 112 A K S >> S+ 0 0 86 224,-0.0 3,-0.6 201,-0.0 4,-0.5 -0.982 73.4 1.1-161.6 158.6 68.3 35.8 -25.2 110 113 A G H >> S- 0 0 35 -2,-0.3 4,-2.3 1,-0.2 3,-0.7 -0.251 117.2 -8.6 63.6-149.8 64.8 36.6 -24.1 111 114 A V H 3> S+ 0 0 54 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.851 132.2 54.2 -50.9 -48.1 62.0 34.1 -23.9 112 115 A V H <> S+ 0 0 8 -3,-0.6 4,-2.0 -7,-0.3 -1,-0.2 0.877 111.9 44.8 -64.4 -34.4 63.9 31.2 -25.5 113 116 A H H S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 4,-0.7 0.928 113.4 49.1 -61.6 -40.7 71.9 16.5 -7.8 129 132 A K H ><5S+ 0 0 20 -4,-2.8 3,-0.9 -5,-0.3 -1,-0.2 0.902 109.3 50.3 -64.7 -44.0 69.0 14.6 -6.2 130 133 A Q H 3<5S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.839 113.0 48.5 -63.9 -29.1 70.0 11.2 -7.8 131 134 A E H 3<5S- 0 0 36 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.537 112.2-125.5 -84.0 -9.1 73.6 11.9 -6.5 132 135 A G T <<5S+ 0 0 43 -3,-0.9 -3,-0.2 -4,-0.7 -2,-0.1 0.812 72.2 111.5 68.4 34.2 72.2 12.6 -3.0 133 136 A K S -e 414 0C 12 0, 0.0 4,-2.4 0, 0.0 3,-0.4 -0.428 44.0-108.6 -63.6 152.5 72.8 19.7 -2.9 135 138 A V H > S+ 0 0 0 279,-2.4 4,-2.6 1,-0.2 5,-0.2 0.887 119.2 57.9 -53.9 -43.7 73.9 21.3 -6.2 136 139 A W H > S+ 0 0 8 278,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.930 111.3 43.0 -54.3 -38.5 76.6 23.4 -4.5 137 140 A K H > S+ 0 0 45 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.876 109.6 55.8 -78.1 -35.6 78.2 20.1 -3.2 138 141 A L H X S+ 0 0 12 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.917 113.1 43.2 -58.4 -45.3 77.8 18.3 -6.5 139 142 A L H >< S+ 0 0 2 -4,-2.6 3,-0.9 2,-0.2 -2,-0.2 0.932 112.7 51.1 -66.1 -50.6 79.8 21.1 -8.1 140 143 A V H 3< S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.880 114.3 44.7 -52.2 -43.1 82.4 21.3 -5.3 141 144 A D H 3< S+ 0 0 68 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.586 89.9 113.7 -81.6 -9.7 83.0 17.5 -5.5 142 145 A M S << S- 0 0 18 -3,-0.9 -3,-0.0 -4,-0.7 -4,-0.0 -0.343 76.3-112.6 -70.4 136.5 83.1 17.4 -9.4 143 146 A D >> - 0 0 100 1,-0.1 4,-2.5 -2,-0.1 3,-0.6 -0.480 29.0-122.2 -60.2 132.4 86.4 16.6 -11.1 144 147 A P H 3> S+ 0 0 25 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.868 113.8 51.7 -50.4 -38.4 87.6 19.8 -12.9 145 148 A R H 3> S+ 0 0 165 1,-0.2 4,-1.8 2,-0.2 21,-0.0 0.893 110.8 48.9 -65.2 -35.5 87.6 18.0 -16.3 146 149 A M H <4 S+ 0 0 55 -3,-0.6 4,-0.4 2,-0.2 -1,-0.2 0.919 110.9 49.5 -66.6 -47.6 84.0 16.8 -15.6 147 150 A L H >< S+ 0 0 3 -4,-2.5 3,-2.1 1,-0.2 4,-0.3 0.950 110.7 48.4 -59.2 -48.5 82.9 20.4 -14.7 148 151 A V H >< S+ 0 0 5 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.863 103.0 64.1 -64.5 -27.6 84.5 22.0 -17.9 149 152 A S T 3< S+ 0 0 33 -4,-1.8 -59,-2.0 1,-0.3 -1,-0.3 0.640 98.1 56.8 -65.8 -16.0 82.7 19.2 -19.9 150 153 A C T < S+ 0 0 0 -3,-2.1 2,-0.4 -4,-0.4 -1,-0.3 0.512 96.2 85.4 -87.5 -10.9 79.4 20.7 -18.8 151 154 A I < - 0 0 0 -3,-1.7 2,-0.6 -4,-0.3 -61,-0.2 -0.837 67.9-143.9-106.0 133.3 80.3 24.1 -20.2 152 155 A D - 0 0 5 -2,-0.4 189,-0.1 1,-0.1 -3,-0.1 -0.813 14.8-175.0 -86.4 117.5 79.8 25.6 -23.7 153 156 A F >> + 0 0 6 -2,-0.6 3,-2.3 -5,-0.1 4,-1.0 0.355 33.1 137.9 -94.8 3.2 82.9 27.9 -24.4 154 157 A R T 34 S+ 0 0 67 1,-0.3 -2,-0.1 2,-0.2 0, 0.0 -0.241 76.6 8.2 -53.5 137.3 81.6 29.1 -27.8 155 158 A Y T 34 S+ 0 0 114 1,-0.1 -1,-0.3 157,-0.0 -2,-0.1 0.418 123.9 67.8 71.2 2.4 82.3 32.9 -28.2 156 159 A I T X> + 0 0 0 -3,-2.3 4,-2.7 4,-0.1 3,-2.3 0.442 62.1 96.1-126.2 -2.7 84.4 33.1 -25.0 157 160 A T T 3< S+ 0 0 81 -4,-1.0 4,-0.1 1,-0.3 -3,-0.1 0.713 76.7 70.0 -60.7 -17.3 87.6 31.1 -25.9 158 161 A D T 34 S+ 0 0 96 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.637 118.8 18.0 -72.0 -17.1 89.2 34.5 -26.7 159 162 A V T <4 S+ 0 0 14 -3,-2.3 2,-0.3 1,-0.2 -2,-0.2 0.545 139.4 26.1-121.5 -24.4 89.2 35.3 -22.9 160 163 A L < - 0 0 0 -4,-2.7 -1,-0.2 -7,-0.1 -2,-0.2 -0.827 66.5-172.4-150.3 99.6 88.7 31.8 -21.3 161 164 A T > - 0 0 42 -2,-0.3 4,-2.1 -4,-0.1 5,-0.1 -0.369 43.6-104.1 -80.3 169.7 89.8 28.6 -23.0 162 165 A E H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.903 126.9 52.5 -58.1 -41.8 88.9 25.1 -21.5 163 166 A E H > S+ 0 0 129 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 107.7 50.2 -60.7 -45.1 92.6 25.0 -20.4 164 167 A D H > S+ 0 0 40 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 110.8 49.9 -60.6 -42.1 92.3 28.4 -18.6 165 168 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.904 110.0 50.7 -63.0 -45.3 89.0 27.1 -16.9 166 169 A L H X S+ 0 0 14 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.874 108.0 52.9 -60.2 -41.4 90.9 24.0 -15.7 167 170 A E H X S+ 0 0 127 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.940 109.7 47.6 -62.6 -43.1 93.8 26.1 -14.3 168 171 A I H X S+ 0 0 20 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.925 114.8 46.8 -63.9 -41.5 91.3 28.2 -12.2 169 172 A L H < S+ 0 0 4 -4,-2.3 4,-0.4 2,-0.2 -1,-0.2 0.841 110.8 51.2 -72.7 -33.5 89.6 25.0 -10.9 170 173 A Q H >< S+ 0 0 105 -4,-2.4 3,-1.4 2,-0.2 4,-0.4 0.945 111.9 46.9 -66.8 -45.3 92.9 23.3 -10.1 171 174 A K H >< S+ 0 0 148 -4,-2.4 3,-1.5 1,-0.3 -2,-0.2 0.873 105.6 61.2 -61.8 -36.6 94.0 26.3 -8.1 172 175 A G T 3< S+ 0 0 3 -4,-2.0 -1,-0.3 204,-0.3 -2,-0.2 0.576 88.2 72.4 -68.7 -12.7 90.6 26.3 -6.4 173 176 A Q T X S+ 0 0 71 -3,-1.4 3,-1.7 -4,-0.4 2,-0.3 0.765 76.4 96.1 -67.3 -32.3 91.3 22.8 -5.0 174 177 A I T < S- 0 0 132 -3,-1.5 -3,-0.0 -4,-0.4 -4,-0.0 -0.531 104.8 -4.1 -68.0 119.0 93.8 24.5 -2.6 175 178 A G T 3> S+ 0 0 25 -2,-0.3 4,-2.3 3,-0.1 -1,-0.3 0.572 89.5 135.7 72.6 16.8 92.1 25.1 0.8 176 179 A K H <> S+ 0 0 33 -3,-1.7 4,-2.4 1,-0.2 5,-0.2 0.856 70.9 51.6 -66.1 -34.5 88.7 23.8 -0.5 177 180 A K H > S+ 0 0 135 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.937 111.1 48.0 -65.8 -44.0 88.1 21.7 2.7 178 181 A E H > S+ 0 0 124 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.901 113.6 47.8 -61.2 -44.1 88.8 24.8 4.9 179 182 A R H X S+ 0 0 32 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.900 110.8 49.9 -68.3 -40.6 86.4 27.0 2.7 180 183 A E H X S+ 0 0 33 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.946 111.2 50.3 -62.7 -42.1 83.6 24.3 2.8 181 184 A K H X S+ 0 0 140 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.917 110.1 50.8 -57.8 -42.5 84.0 24.2 6.6 182 185 A Q H X>S+ 0 0 81 -4,-2.3 4,-2.6 1,-0.2 5,-0.6 0.901 110.5 48.8 -61.1 -44.6 83.8 28.0 6.8 183 186 A M H X5S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.926 112.5 47.4 -61.9 -45.7 80.6 28.0 4.7 184 187 A L H <5S+ 0 0 87 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.834 116.9 44.0 -68.7 -30.9 78.9 25.3 6.8 185 188 A A H <5S+ 0 0 55 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.872 135.3 6.2 -82.5 -37.5 79.9 27.1 10.0 186 189 A Q H <5S- 0 0 92 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.517 91.8-138.4-127.3 -15.8 79.0 30.7 9.2 187 190 A G << - 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