==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBON-OXYGEN LYASE 13-NOV-90 7ENL . COMPND 2 MOLECULE: ENOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR L.LEBIODA,B.STEC . 436 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16190.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 317 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 8.7 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 0.5 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 . 2 0.5 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 . 28 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.5 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 2 3 1 0 1 2 1 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 2 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 PARALLEL BRIDGES PER LADDER . 5 0 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 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 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 71 0, 0.0 2,-0.7 0, 0.0 81,-0.1 0.000 360.0 360.0 360.0 118.8 114.4 17.2 19.3 2 2 A V + 0 0 12 79,-0.4 23,-0.3 1,-0.2 78,-0.2 -0.614 360.0 171.4 -70.8 113.3 111.0 18.7 18.2 3 3 A S + 0 0 77 21,-1.7 2,-0.4 -2,-0.7 -1,-0.2 0.825 60.5 18.5 -97.6 -36.3 109.1 15.7 16.9 4 4 A K E -A 24 0A 103 20,-1.0 20,-2.7 73,-0.1 2,-0.4 -0.982 50.8-170.6-139.4 146.8 105.6 17.1 16.4 5 5 A V E +A 23 0A 7 -2,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.974 25.6 165.9-132.3 111.5 104.1 20.6 16.0 6 6 A Y E -A 22 0A 91 16,-3.2 16,-2.6 -2,-0.4 2,-0.3 -0.917 16.6-161.8-128.4 162.9 100.3 20.6 16.1 7 7 A A E +A 21 0A 1 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.969 6.7 179.5-147.5 150.5 97.5 23.2 16.5 8 8 A R E -A 20 0A 79 12,-2.1 12,-2.4 -2,-0.3 2,-0.4 -0.950 34.1-104.1-141.3 163.1 93.8 23.3 17.4 9 9 A S E +A 19 0A 34 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.751 45.5 162.1 -89.6 130.4 91.1 26.0 17.7 10 10 A V E -A 18 0A 26 8,-2.6 8,-2.4 -2,-0.4 2,-0.2 -0.840 33.8 -93.5-139.6 177.6 90.1 26.9 21.4 11 11 A Y E -A 17 0A 118 -2,-0.3 2,-0.2 6,-0.2 8,-0.0 -0.609 22.4-146.0-107.1 152.2 88.3 29.8 23.0 12 12 A D > - 0 0 11 4,-1.1 3,-3.0 -2,-0.2 366,-0.2 -0.601 46.4 -82.6-103.0 171.2 89.3 33.1 24.6 13 13 A S T 3 S+ 0 0 26 364,-2.5 365,-0.1 1,-0.3 363,-0.1 0.477 130.7 51.9 -49.8 -16.8 87.7 35.0 27.6 14 14 A R T 3 S- 0 0 83 2,-0.2 -1,-0.3 363,-0.2 362,-0.1 0.442 117.9-108.3-107.6 2.0 85.3 36.4 25.1 15 15 A G S < S+ 0 0 45 -3,-3.0 -2,-0.1 1,-0.3 361,-0.0 0.613 78.2 130.9 81.1 17.8 84.1 33.2 23.5 16 16 A N - 0 0 30 1,-0.1 -4,-1.1 20,-0.1 -1,-0.3 -0.827 62.3-104.7-107.3 133.3 86.0 33.9 20.3 17 17 A P E +A 11 0A 0 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 0.069 43.4 169.0 -50.3 157.8 88.3 31.3 18.7 18 18 A T E -A 10 0A 2 -8,-2.4 -8,-2.6 -6,-0.0 2,-0.4 -0.972 35.4 -82.7-163.6 166.6 92.0 31.5 19.0 19 19 A V E -A 9 0A 0 -2,-0.3 15,-2.5 -10,-0.2 2,-0.4 -0.720 28.8-170.1 -90.8 134.1 95.0 29.3 18.3 20 20 A E E -AB 8 33A 16 -12,-2.4 -12,-2.1 -2,-0.4 2,-0.4 -0.968 10.0-162.8-117.6 118.2 96.4 26.7 20.6 21 21 A V E -AB 7 32A 0 11,-2.1 11,-2.0 -2,-0.4 2,-0.4 -0.892 4.8-165.1-109.7 135.7 99.8 25.1 19.7 22 22 A E E -AB 6 31A 22 -16,-2.6 -16,-3.2 -2,-0.4 2,-0.5 -0.985 5.0-166.6-119.7 126.2 101.3 21.9 21.1 23 23 A L E -AB 5 30A 0 7,-2.8 7,-2.9 -2,-0.4 2,-0.4 -0.995 6.4-154.6-117.6 117.0 105.0 21.2 20.6 24 24 A T E +AB 4 29A 28 -20,-2.7 -21,-1.7 -2,-0.5 -20,-1.0 -0.791 23.1 158.2-100.0 136.6 106.3 17.6 21.3 25 25 A T E > - B 0 28A 7 3,-1.8 3,-1.6 -2,-0.4 -23,-0.1 -0.706 62.1 -81.3-139.0 179.9 109.9 17.1 22.3 26 26 A E T 3 S+ 0 0 107 1,-0.3 3,-0.1 -2,-0.2 -24,-0.1 0.587 129.1 54.7 -66.9 -14.6 111.7 14.3 24.1 27 27 A K T 3 S- 0 0 107 1,-0.4 2,-0.3 93,-0.1 -1,-0.3 0.407 119.3 -85.7-100.1 2.1 110.5 15.9 27.3 28 28 A G E < -B 25 0A 29 -3,-1.6 -3,-1.8 2,-0.0 2,-0.4 -0.789 59.0 -43.5 128.3-177.1 106.8 16.1 26.7 29 29 A V E -B 24 0A 75 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.3 -0.857 46.5-160.5-100.3 130.3 104.2 18.3 25.0 30 30 A F E -B 23 0A 33 -7,-2.9 -7,-2.8 -2,-0.4 2,-0.3 -0.916 9.6-159.3-113.8 139.9 104.4 22.0 25.5 31 31 A R E -B 22 0A 119 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.847 13.9-178.6-123.6 153.9 101.4 24.3 24.9 32 32 A S E -B 21 0A 0 -11,-2.0 -11,-2.1 -2,-0.3 2,-0.4 -0.980 10.7-158.2-144.7 145.6 100.8 27.9 24.2 33 33 A I E -B 20 0A 9 -2,-0.3 -13,-0.2 -13,-0.2 349,-0.1 -0.993 19.2-137.2-125.5 133.1 97.5 29.7 23.7 34 34 A V - 0 0 2 -15,-2.5 2,-0.2 -2,-0.4 -15,-0.1 -0.706 18.5-119.5 -90.3 144.0 97.6 33.0 21.8 35 35 A P - 0 0 14 0, 0.0 2,-0.9 0, 0.0 342,-0.2 -0.514 8.2-141.1 -82.4 148.2 95.6 36.0 23.0 36 36 A S B -C 376 0B 12 340,-2.4 340,-0.9 -2,-0.2 2,-0.4 -0.884 28.6-167.5-105.2 84.4 92.9 37.6 20.7 37 37 A G - 0 0 11 -2,-0.9 2,-0.1 338,-0.2 337,-0.1 -0.725 38.1-101.2 -81.1 134.9 93.6 41.2 21.7 38 38 A A - 0 0 40 -2,-0.4 2,-0.2 1,-0.1 337,-0.1 -0.467 53.9-118.7 -49.1 117.9 90.9 43.6 20.5 39 39 A S + 0 0 64 -2,-0.1 2,-0.3 335,-0.0 -1,-0.1 -0.495 56.6 146.3 -65.0 131.1 93.1 44.7 17.5 40 40 A T + 0 0 58 -2,-0.2 284,-0.1 1,-0.2 210,-0.0 -0.807 34.1 77.5-168.6 113.8 94.0 48.4 17.6 41 41 A G - 0 0 7 -2,-0.3 3,-0.4 3,-0.1 -1,-0.2 0.230 65.6-135.2 137.1 92.3 97.3 49.7 16.4 42 42 A V S S+ 0 0 88 1,-0.2 -2,-0.1 279,-0.1 0, 0.0 -0.215 93.3 47.0 -53.2 165.3 97.9 50.1 12.7 43 43 A H S S+ 0 0 78 1,-0.2 2,-0.3 286,-0.0 -1,-0.2 0.834 84.6 115.7 62.4 44.2 101.5 48.7 12.3 44 44 A E S S- 0 0 26 -3,-0.4 305,-0.2 57,-0.1 -1,-0.2 -0.846 77.5 -76.7-132.4 159.6 101.3 45.3 14.2 45 45 A A - 0 0 8 303,-2.0 2,-0.3 -2,-0.3 57,-0.2 -0.343 60.9-107.3 -62.2 138.2 101.5 41.7 13.1 46 46 A L - 0 0 44 55,-3.1 61,-2.8 303,-0.1 62,-0.3 -0.525 21.3-132.7 -82.7 138.0 98.3 40.7 11.4 47 47 A E - 0 0 112 -2,-0.3 2,-0.7 59,-0.2 59,-0.1 -0.621 21.7-134.9 -69.9 129.3 95.8 38.5 13.1 48 48 A M + 0 0 35 -2,-0.2 16,-0.4 57,-0.1 2,-0.4 -0.797 31.7 162.9-117.5 110.8 94.5 35.6 10.8 49 49 A R - 0 0 68 -2,-0.7 12,-0.3 1,-0.1 11,-0.1 -0.922 44.3-124.2-116.0 142.6 90.8 34.9 10.7 50 50 A D - 0 0 31 10,-1.2 9,-0.2 -2,-0.4 3,-0.1 0.753 26.6-152.0 -52.1 -39.3 88.5 32.9 8.3 51 51 A G + 0 0 41 7,-1.6 2,-0.9 9,-0.3 8,-0.1 0.535 45.4 145.5 74.2 0.7 86.2 35.9 7.7 52 52 A D > - 0 0 73 1,-0.2 3,-1.7 3,-0.1 6,-0.8 -0.673 38.1-160.8 -73.4 104.9 83.6 33.1 7.0 53 53 A K T 3 S+ 0 0 178 -2,-0.9 4,-0.3 1,-0.3 -1,-0.2 0.631 84.4 65.2 -65.8 -13.6 80.4 34.8 8.5 54 54 A S T 3 S+ 0 0 95 1,-0.1 2,-0.3 3,-0.1 -1,-0.3 0.214 103.3 56.5 -89.9 9.9 78.5 31.5 8.8 55 55 A K S X >S- 0 0 102 -3,-1.7 3,-2.9 5,-0.0 5,-0.7 -0.921 123.5 -17.9-153.1 122.1 81.1 30.4 11.4 56 56 A W G > 5S- 0 0 73 -2,-0.3 3,-1.2 1,-0.3 -2,-0.1 0.775 116.7 -68.2 58.7 30.4 82.2 31.9 14.7 57 57 A M G 3 5S- 0 0 151 -4,-0.3 -1,-0.3 1,-0.3 -4,-0.2 0.598 97.1 -55.7 67.5 11.8 80.7 35.2 13.4 58 58 A G G < 5S+ 0 0 9 -3,-2.9 -7,-1.6 -6,-0.8 -1,-0.3 0.555 118.6 110.6 90.9 19.6 83.6 35.1 10.9 59 59 A K T < 5 + 0 0 84 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.1 0.198 36.3 136.3-110.2 19.0 86.3 34.8 13.5 60 60 A G < - 0 0 0 -5,-0.7 -10,-1.2 -8,-0.3 -9,-0.3 -0.102 42.6-157.9 -58.6 164.8 87.5 31.3 13.0 61 61 A V > + 0 0 0 -12,-0.3 4,-3.3 -43,-0.1 5,-0.2 -0.106 53.2 126.2-134.7 21.7 91.3 30.8 13.0 62 62 A L H > S+ 0 0 59 2,-0.2 4,-1.1 1,-0.2 -13,-0.1 0.725 74.1 49.2 -54.5 -27.9 91.0 27.5 11.0 63 63 A H H > S+ 0 0 80 2,-0.2 4,-3.9 -15,-0.2 5,-0.3 0.954 111.1 46.2 -72.0 -63.3 93.4 28.9 8.4 64 64 A A H > S+ 0 0 0 -16,-0.4 4,-1.6 1,-0.3 -2,-0.2 0.882 112.1 53.6 -44.5 -48.6 96.0 30.0 10.9 65 65 A V H X S+ 0 0 14 -4,-3.3 4,-2.1 1,-0.2 -1,-0.3 0.853 111.9 45.0 -57.5 -46.0 95.4 26.5 12.4 66 66 A K H X>S+ 0 0 108 -4,-1.1 4,-3.5 -5,-0.2 5,-1.0 0.899 104.5 61.3 -64.8 -45.3 96.1 25.2 8.9 67 67 A N H X>S+ 0 0 28 -4,-3.9 5,-3.3 1,-0.2 4,-0.5 0.841 113.2 38.7 -49.8 -37.0 99.2 27.4 8.5 68 68 A V H <>S+ 0 0 0 -4,-1.6 5,-4.0 -5,-0.3 -1,-0.2 0.940 121.5 40.3 -76.5 -56.9 100.7 25.6 11.6 69 69 A N H <5S+ 0 0 41 -4,-2.1 -2,-0.2 3,-0.2 -3,-0.2 0.895 130.1 25.1 -63.2 -50.8 99.6 22.1 10.9 70 70 A D H <5S+ 0 0 125 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.1 0.787 136.1 22.9 -92.4 -28.1 100.1 22.0 7.1 71 71 A V T X S+ 0 0 39 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.933 118.6 40.0 -41.0 -56.4 106.3 19.9 8.4 75 75 A A H X S+ 0 0 29 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.889 115.1 52.1 -65.3 -43.5 109.1 22.5 7.9 76 76 A F H X>S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 5,-0.6 0.915 109.6 48.2 -63.4 -45.4 109.8 23.0 11.6 77 77 A V H ><5S+ 0 0 59 -4,-3.2 3,-0.9 -5,-0.3 -2,-0.2 0.959 114.8 47.4 -59.1 -49.4 110.2 19.3 12.2 78 78 A K H 3<5S+ 0 0 164 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.841 103.0 61.7 -57.3 -44.5 112.5 19.1 9.3 79 79 A A H 3<5S- 0 0 45 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.748 90.5-148.2 -58.8 -32.2 114.6 22.1 10.3 80 80 A N T <<5 - 0 0 114 -4,-1.0 2,-0.4 -3,-0.9 -3,-0.1 0.989 24.0-170.7 52.3 64.9 115.7 20.3 13.5 81 81 A I < - 0 0 25 -5,-0.6 2,-0.9 -79,-0.1 -79,-0.4 -0.725 27.7-123.6 -91.2 133.4 115.9 23.6 15.5 82 82 A D > - 0 0 82 -2,-0.4 3,-1.8 1,-0.2 7,-0.2 -0.760 19.8-150.9 -74.8 105.9 117.4 23.6 18.9 83 83 A V T 3 S+ 0 0 5 -2,-0.9 38,-0.3 1,-0.3 -1,-0.2 0.591 92.0 71.2 -54.5 -22.0 114.5 25.1 20.9 84 84 A S T 3 S+ 0 0 32 1,-0.2 2,-1.1 36,-0.1 -1,-0.3 0.795 86.0 74.6 -60.8 -37.2 117.0 26.6 23.3 85 85 A D <> + 0 0 78 -3,-1.8 4,-2.1 1,-0.2 -1,-0.2 -0.668 61.4 173.6 -90.1 84.9 117.9 29.0 20.5 86 86 A Q H > S+ 0 0 4 -2,-1.1 4,-2.6 2,-0.2 267,-0.3 0.890 76.8 51.7 -63.5 -48.8 114.9 31.3 20.5 87 87 A K H > S+ 0 0 124 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.963 110.5 51.8 -58.8 -46.9 116.3 33.7 17.9 88 88 A A H > S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.857 110.2 49.2 -55.2 -42.5 116.9 30.7 15.7 89 89 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.896 115.5 41.6 -63.8 -49.3 113.3 29.5 16.2 90 90 A D H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.822 111.0 56.2 -68.7 -36.4 111.8 32.9 15.4 91 91 A D H X S+ 0 0 100 -4,-3.5 4,-2.2 1,-0.2 -2,-0.2 0.925 110.1 46.8 -61.0 -41.3 114.1 33.6 12.4 92 92 A F H X S+ 0 0 35 -4,-1.9 4,-1.2 -5,-0.3 -1,-0.2 0.891 112.0 50.6 -66.2 -39.7 112.9 30.4 11.0 93 93 A L H X S+ 0 0 0 -4,-1.8 4,-0.9 1,-0.2 -2,-0.2 0.893 113.4 44.3 -67.0 -39.6 109.3 31.3 11.7 94 94 A I H X S+ 0 0 45 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.844 106.0 61.8 -69.7 -35.6 109.6 34.7 10.1 95 95 A S H < S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.800 104.4 49.6 -60.5 -34.2 111.5 33.2 7.0 96 96 A L H < S+ 0 0 46 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.757 114.6 42.9 -76.1 -35.1 108.5 31.1 6.1 97 97 A D H < S- 0 0 6 -4,-0.9 -2,-0.2 -3,-0.2 -1,-0.2 0.885 80.8-170.7 -78.0 -44.9 106.1 34.0 6.3 98 98 A G < + 0 0 63 -4,-2.6 2,-0.3 1,-0.2 -3,-0.1 0.602 45.7 108.5 60.1 17.4 108.3 36.5 4.5 99 99 A T S > S- 0 0 43 -5,-0.3 3,-0.7 1,-0.1 -1,-0.2 -0.834 72.3-129.5-115.9 158.5 106.1 39.5 5.3 100 100 A A T 3 S+ 0 0 106 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.723 109.7 41.2 -78.6 -21.5 107.0 42.3 7.7 101 101 A N T 3 S- 0 0 72 -56,-0.1 -55,-3.1 -4,-0.1 6,-0.3 0.147 111.0-113.0-111.6 21.4 103.7 42.0 9.4 102 102 A K S <> S+ 0 0 6 -3,-0.7 4,-1.1 -57,-0.2 5,-0.5 0.759 70.2 140.6 51.2 37.7 103.2 38.3 9.5 103 103 A S T 4 + 0 0 43 3,-0.2 -1,-0.1 2,-0.2 -5,-0.1 0.497 60.1 60.0 -87.7 0.5 100.3 38.5 7.0 104 104 A K T 4 S+ 0 0 112 -5,-0.0 -1,-0.1 1,-0.0 -7,-0.1 0.949 128.4 9.6 -86.9 -60.1 101.2 35.4 5.0 105 105 A L T 4 S- 0 0 0 -6,-0.1 4,-0.3 -38,-0.0 -2,-0.2 0.594 113.2-118.6 -89.1 -16.6 101.1 32.8 7.8 106 106 A G >X - 0 0 0 -4,-1.1 4,-1.8 1,-0.1 3,-0.7 0.564 14.6-101.8 82.8 128.9 99.5 35.2 10.3 107 107 A A H 3> S+ 0 0 4 -61,-2.8 4,-1.9 -5,-0.5 -60,-0.2 0.635 117.5 58.1 -53.1 -19.1 100.8 36.3 13.7 108 108 A N H 3> S+ 0 0 12 -62,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.828 106.3 47.8 -86.8 -30.7 98.6 33.9 15.6 109 109 A A H <> S+ 0 0 0 -3,-0.7 4,-1.1 -4,-0.3 -2,-0.2 0.831 117.4 42.8 -77.4 -33.3 100.0 30.9 13.9 110 110 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.922 109.8 54.2 -80.3 -43.9 103.5 32.1 14.5 111 111 A L H X S+ 0 0 0 -4,-1.9 4,-3.7 2,-0.2 5,-0.4 0.977 103.5 56.5 -50.9 -61.7 103.2 33.2 18.1 112 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.3 5,-0.3 0.900 112.3 42.2 -36.8 -59.9 101.8 29.9 19.3 113 113 A V H X S+ 0 0 0 -4,-1.1 4,-2.2 1,-0.2 -1,-0.3 0.893 114.4 51.0 -58.4 -45.6 104.9 28.1 17.9 114 114 A S H X S+ 0 0 0 -4,-2.6 4,-1.1 236,-0.2 -1,-0.2 0.905 113.7 44.4 -59.6 -39.9 107.3 30.8 19.2 115 115 A L H X S+ 0 0 4 -4,-3.7 4,-0.9 1,-0.2 3,-0.4 0.937 113.1 50.4 -75.4 -40.7 105.7 30.6 22.8 116 116 A A H >X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.4 3,-0.6 0.893 104.2 59.2 -59.6 -43.3 105.6 26.8 22.9 117 117 A A H 3X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.907 102.4 52.3 -51.7 -50.1 109.3 26.6 21.9 118 118 A S H 3X S+ 0 0 0 -4,-1.1 4,-1.1 -3,-0.4 -1,-0.2 0.820 110.3 48.0 -59.4 -31.4 110.4 28.6 24.9 119 119 A R H S+ 0 0 4 -4,-1.1 4,-2.0 2,-0.2 5,-2.0 0.913 108.8 49.9 -71.6 -43.7 112.8 25.5 29.8 123 123 A A H <5S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.830 113.3 46.2 -59.1 -39.4 111.9 21.9 30.4 124 124 A E H <5S+ 0 0 60 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.848 114.0 46.9 -73.9 -32.5 115.0 20.8 28.6 125 125 A K H <5S- 0 0 72 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.701 109.8-131.0 -77.2 -29.4 117.1 23.3 30.5 126 126 A N T <5 + 0 0 132 -4,-2.0 -3,-0.2 1,-0.3 -4,-0.1 0.714 65.7 119.2 78.4 35.4 115.3 22.1 33.6 127 127 A V S > - 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