==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 29-DEC-09 3L7O . COMPND 2 MOLECULE: RIBOSE-5-PHOSPHATE ISOMERASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS MUTANS; . AUTHOR X.X.FAN,K.T.WANG,X.D.SU . 445 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18595.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 326 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 53 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 13.5 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 . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 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 . 39 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1 3 5 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 1 5 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 6 4 1 2 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 . 2 0 4 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 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 2 A E > 0 0 127 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -44.9 56.3 -0.2 -7.8 2 3 A E H > + 0 0 172 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.890 360.0 50.7 -64.5 -40.6 56.0 -3.1 -10.2 3 4 A L H > S+ 0 0 97 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.841 105.8 55.1 -66.2 -37.8 55.0 -5.1 -7.1 4 5 A K H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.899 108.6 48.1 -63.7 -41.7 52.4 -2.5 -6.1 5 6 A K H X S+ 0 0 117 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.920 111.2 49.7 -65.3 -43.5 50.8 -2.8 -9.5 6 7 A I H X S+ 0 0 95 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.923 113.0 48.4 -57.9 -40.9 50.8 -6.6 -9.3 7 8 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.936 111.6 48.4 -65.1 -46.2 49.1 -6.3 -5.8 8 9 A G H X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.897 113.8 46.9 -62.0 -39.7 46.5 -3.8 -7.0 9 10 A V H X S+ 0 0 39 -4,-2.4 4,-0.7 -5,-0.2 3,-0.2 0.877 109.0 55.1 -67.9 -42.7 45.6 -6.0 -10.0 10 11 A R H >< S+ 0 0 75 -4,-2.3 3,-1.3 1,-0.2 4,-0.4 0.926 105.6 52.5 -60.6 -37.1 45.5 -9.1 -7.7 11 12 A A H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.859 99.1 64.1 -67.6 -23.8 42.9 -7.3 -5.6 12 13 A A H >< S+ 0 0 1 -4,-1.1 3,-2.0 1,-0.3 -1,-0.3 0.730 83.1 78.5 -73.4 -16.0 40.8 -6.6 -8.7 13 14 A Q T << S+ 0 0 117 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.831 83.1 64.3 -65.4 -18.7 40.3 -10.4 -9.0 14 15 A Y T < S+ 0 0 47 -3,-1.4 2,-0.5 -4,-0.4 -1,-0.3 0.623 84.7 92.2 -73.8 -11.0 37.7 -10.1 -6.3 15 16 A V < + 0 0 1 -3,-2.0 2,-0.3 -4,-0.2 6,-0.0 -0.748 56.9 177.6 -87.4 127.7 35.6 -8.0 -8.6 16 17 A E > - 0 0 121 -2,-0.5 3,-1.6 1,-0.1 -2,-0.0 -0.884 39.5 -76.0-127.1 157.2 32.9 -9.9 -10.7 17 18 A D T 3 S+ 0 0 104 -2,-0.3 30,-0.2 1,-0.2 -1,-0.1 -0.179 115.4 25.3 -48.6 142.8 30.3 -8.9 -13.2 18 19 A G T 3 S+ 0 0 66 28,-3.7 -1,-0.2 1,-0.3 29,-0.2 0.445 91.8 131.3 82.0 -2.2 27.2 -7.4 -11.6 19 20 A M < - 0 0 31 -3,-1.6 29,-1.5 27,-0.4 2,-0.5 -0.518 58.4-130.6 -83.0 156.6 28.9 -6.2 -8.3 20 21 A I E -a 48 0A 33 27,-0.2 58,-1.7 -2,-0.1 57,-1.4 -0.902 37.8-163.6 -95.2 128.8 28.7 -2.8 -6.7 21 22 A V E -ab 49 78A 0 27,-3.1 29,-2.1 -2,-0.5 2,-0.4 -0.952 17.7-136.1-128.2 125.6 32.3 -2.0 -6.0 22 23 A G E -ab 50 79A 0 56,-2.6 58,-2.2 -2,-0.5 2,-0.6 -0.688 18.1-155.2 -78.4 137.2 33.9 0.6 -3.7 23 24 A L E +ab 51 80A 0 27,-2.8 29,-1.7 -2,-0.4 30,-0.3 -0.913 20.1 173.9-121.1 111.4 36.7 2.4 -5.3 24 25 A G - 0 0 0 56,-1.6 2,-0.3 -2,-0.6 57,-0.2 0.047 23.4-113.4-105.1-156.3 39.4 3.9 -3.0 25 26 A T + 0 0 38 57,-0.1 57,-1.7 27,-0.1 2,-0.2 -0.928 45.9 116.3-140.2 163.2 42.8 5.7 -3.1 26 27 A G S > S- 0 0 32 -2,-0.3 4,-2.3 55,-0.1 5,-0.2 -0.622 72.8 -87.4 148.4 157.6 46.3 4.8 -2.1 27 28 A S T 4 S+ 0 0 59 -2,-0.2 4,-0.2 1,-0.2 -1,-0.1 0.831 130.9 26.9 -61.1 -38.4 49.7 4.3 -3.7 28 29 A T T >> S+ 0 0 2 88,-0.3 3,-1.6 2,-0.1 4,-0.7 0.828 116.5 59.3 -88.7 -39.5 48.8 0.5 -4.3 29 30 A A H 3> S+ 0 0 0 87,-0.5 4,-1.9 1,-0.3 3,-0.5 0.763 90.9 73.3 -65.1 -25.3 44.9 0.8 -4.5 30 31 A Y H 3X S+ 0 0 109 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.902 95.6 51.3 -51.9 -38.8 45.4 3.2 -7.4 31 32 A Y H <> S+ 0 0 52 -3,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.803 103.6 57.7 -69.8 -29.1 46.3 0.1 -9.5 32 33 A F H X S+ 0 0 0 -4,-0.7 4,-2.4 -3,-0.5 -1,-0.2 0.934 107.6 46.3 -67.1 -45.0 43.2 -1.7 -8.4 33 34 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.907 111.2 52.7 -61.7 -39.9 41.0 1.1 -9.8 34 35 A E H X S+ 0 0 63 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.897 109.7 49.7 -60.0 -38.3 43.1 1.1 -13.1 35 36 A E H X S+ 0 0 31 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.891 109.0 50.0 -73.2 -42.5 42.5 -2.6 -13.4 36 37 A V H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.957 112.6 49.5 -55.9 -43.8 38.7 -2.3 -12.8 37 38 A G H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.919 110.3 49.5 -65.4 -40.7 38.7 0.4 -15.5 38 39 A R H X S+ 0 0 88 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.893 108.3 51.5 -60.8 -40.8 40.6 -1.8 -17.9 39 40 A R H X S+ 0 0 40 -4,-2.4 6,-2.0 2,-0.2 4,-2.0 0.862 112.0 49.6 -64.6 -33.9 38.3 -4.8 -17.4 40 41 A V H X S+ 0 0 31 -4,-2.3 4,-0.7 -5,-0.2 -2,-0.2 0.971 116.9 40.4 -68.7 -43.6 35.4 -2.4 -18.2 41 42 A Q H < S+ 0 0 105 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.872 132.9 20.0 -71.1 -37.3 37.1 -1.1 -21.3 42 43 A E H < S+ 0 0 134 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.651 126.8 38.2-114.7 -20.6 38.5 -4.4 -22.6 43 44 A E H < S- 0 0 116 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.1 0.235 98.7-112.2-124.7 8.7 36.6 -7.4 -21.1 44 45 A G < + 0 0 44 -4,-0.7 -4,-0.2 1,-0.2 -3,-0.1 0.713 50.9 175.6 71.7 20.1 33.0 -6.2 -21.0 45 46 A L - 0 0 8 -6,-2.0 2,-0.7 -9,-0.1 -1,-0.2 -0.412 19.0-151.8 -66.8 138.9 32.9 -6.1 -17.2 46 47 A Q + 0 0 129 -2,-0.1 -28,-3.7 19,-0.1 -27,-0.4 -0.917 35.4 136.7-114.0 110.2 29.7 -4.7 -15.9 47 48 A V - 0 0 7 -2,-0.7 2,-0.4 -30,-0.2 -27,-0.2 -0.893 45.2-136.4-142.3 165.3 30.0 -2.9 -12.5 48 49 A I E -a 20 0A 40 -29,-1.5 -27,-3.1 -2,-0.3 2,-0.3 -0.998 26.4-151.2-121.8 126.6 28.9 0.2 -10.6 49 50 A G E -ac 21 67A 0 17,-2.9 19,-2.4 -2,-0.4 2,-0.4 -0.629 10.7-163.0 -99.5 151.9 31.6 1.9 -8.6 50 51 A V E -a 22 0A 0 -29,-2.1 -27,-2.8 -2,-0.3 2,-0.2 -0.987 22.0-149.4-131.7 116.0 31.1 4.0 -5.4 51 52 A T E -a 23 0A 10 -2,-0.4 -27,-0.2 17,-0.3 19,-0.2 -0.547 19.5-152.1 -97.6 164.8 34.2 6.2 -4.8 52 53 A T S S+ 0 0 0 -29,-1.7 2,-0.3 -2,-0.2 51,-0.3 0.472 83.1 31.1-104.6 -2.2 35.6 7.4 -1.5 53 54 A S S > S- 0 0 18 -30,-0.3 4,-1.9 49,-0.1 3,-0.3 -0.995 73.2-123.4-158.2 147.6 37.2 10.6 -3.0 54 55 A S H > S+ 0 0 71 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.756 113.2 62.4 -73.8 -16.6 36.6 13.1 -5.9 55 56 A R H > S+ 0 0 192 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 107.3 43.6 -69.8 -37.0 40.1 12.2 -7.2 56 57 A T H > S+ 0 0 2 -3,-0.3 4,-3.1 1,-0.2 5,-0.3 0.849 108.0 58.2 -75.2 -34.3 38.8 8.6 -7.7 57 58 A T H X S+ 0 0 38 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.964 110.5 43.9 -57.7 -42.2 35.6 9.9 -9.2 58 59 A A H X S+ 0 0 57 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.926 114.5 49.6 -66.5 -42.3 37.7 11.7 -11.9 59 60 A Q H X S+ 0 0 26 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.930 113.9 44.8 -59.1 -53.1 40.0 8.6 -12.3 60 61 A A H X>S+ 0 0 0 -4,-3.1 5,-2.5 1,-0.2 4,-0.7 0.895 112.1 51.7 -64.3 -39.2 36.9 6.3 -12.7 61 62 A Q H ><5S+ 0 0 129 -4,-2.7 3,-0.8 -5,-0.3 -1,-0.2 0.905 107.4 53.2 -65.9 -39.9 35.1 8.7 -15.1 62 63 A A H 3<5S+ 0 0 84 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.875 113.3 44.2 -58.5 -39.9 38.3 8.9 -17.3 63 64 A L H 3<5S- 0 0 23 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.490 115.1-119.2 -83.7 -4.5 38.2 5.1 -17.5 64 65 A G T <<5 + 0 0 46 -3,-0.8 -3,-0.2 -4,-0.7 -4,-0.1 0.795 55.3 157.4 72.4 28.5 34.4 5.0 -18.1 65 66 A I < - 0 0 6 -5,-2.5 -1,-0.3 -6,-0.1 -17,-0.1 -0.779 46.6-121.1 -79.7 123.4 33.5 3.0 -14.9 66 67 A P - 0 0 70 0, 0.0 -17,-2.9 0, 0.0 2,-0.3 -0.398 36.1-158.4 -65.4 140.4 29.8 3.9 -14.3 67 68 A L B +c 49 0A 50 -19,-0.2 2,-0.3 -2,-0.1 -17,-0.2 -0.883 20.8 173.1-119.3 159.0 29.4 5.4 -10.8 68 69 A K - 0 0 101 -19,-2.4 -17,-0.3 -2,-0.3 2,-0.1 -0.969 35.3-102.8-145.7 165.0 26.7 6.0 -8.2 69 70 A S > - 0 0 33 -2,-0.3 3,-2.0 -19,-0.1 4,-0.5 -0.453 35.9-108.0 -80.8 163.0 26.6 7.3 -4.5 70 71 A I G > S+ 0 0 1 1,-0.3 3,-0.6 2,-0.2 -1,-0.1 0.757 120.9 62.7 -55.4 -28.6 26.4 5.0 -1.5 71 72 A D G 3 S+ 0 0 38 1,-0.2 -1,-0.3 292,-0.1 289,-0.0 0.680 98.6 55.9 -72.9 -18.4 22.8 6.3 -1.1 72 73 A E G < S+ 0 0 122 -3,-2.0 2,-0.3 291,-0.0 -1,-0.2 0.448 102.8 58.5-101.1 7.9 21.8 4.8 -4.5 73 74 A V S < S- 0 0 10 -3,-0.6 3,-0.1 -4,-0.5 -23,-0.0 -0.846 71.3-136.2-128.2 166.3 22.8 1.2 -3.9 74 75 A D S S- 0 0 136 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.713 83.2 -9.5 -84.2 -26.2 21.8 -1.4 -1.3 75 76 A S - 0 0 17 35,-0.0 2,-0.5 36,-0.0 -1,-0.3 -0.900 64.7-123.3-168.1 145.3 25.1 -3.0 -0.3 76 77 A V E - d 0 110A 0 33,-1.9 35,-2.9 -2,-0.3 36,-0.4 -0.974 20.1-158.1 -99.7 120.6 28.6 -2.6 -1.7 77 78 A D E S+ 0 0 42 -57,-1.4 35,-1.6 -2,-0.5 2,-0.4 0.937 72.0 3.4 -65.6 -46.5 29.9 -6.1 -2.6 78 79 A V E -bd 21 112A 2 -58,-1.7 -56,-2.6 33,-0.2 2,-0.4 -0.996 61.6-171.0-145.9 134.1 33.6 -5.5 -2.6 79 80 A T E -bd 22 113A 0 33,-1.9 35,-3.0 -2,-0.4 2,-0.5 -1.000 2.6-168.3-124.8 129.1 35.7 -2.4 -1.7 80 81 A V E +bd 23 114A 0 -58,-2.2 -56,-1.6 -2,-0.4 2,-0.3 -0.987 22.5 154.4-115.7 125.3 39.3 -2.1 -2.3 81 82 A D E - d 0 115A 0 33,-2.3 35,-2.2 -2,-0.5 -55,-0.1 -0.888 36.9-113.5-138.2 168.5 41.0 0.9 -0.6 82 83 A G - 0 0 3 -57,-1.7 2,-0.3 -2,-0.3 35,-0.2 -0.260 23.9-149.2 -88.5-179.9 44.4 1.8 0.7 83 84 A A - 0 0 9 33,-0.2 11,-0.2 1,-0.1 3,-0.1 -0.976 18.7-143.7-151.7 146.7 45.6 2.4 4.2 84 85 A D S S+ 0 0 41 9,-1.9 2,-0.3 -2,-0.3 10,-0.2 0.869 90.9 0.9 -79.7 -30.5 48.2 4.6 5.9 85 86 A E E -G 93 0B 8 8,-1.8 8,-1.9 44,-0.0 2,-0.4 -0.982 59.9-168.8-149.7 148.0 49.0 1.9 8.5 86 87 A V E -Gh 92 122B 1 35,-2.5 37,-2.4 -2,-0.3 6,-0.2 -0.998 13.1-153.3-139.8 135.9 47.7 -1.6 9.3 87 88 A D > - 0 0 11 4,-2.7 3,-2.2 -2,-0.4 37,-0.2 -0.437 36.1 -98.6-104.9 167.8 48.5 -3.4 12.5 88 89 A P T 3 S+ 0 0 76 0, 0.0 36,-0.1 0, 0.0 37,-0.1 0.610 121.8 60.2 -66.6 -9.7 48.7 -7.2 13.1 89 90 A N T 3 S- 0 0 125 2,-0.1 115,-0.2 130,-0.0 131,-0.1 0.230 119.1-108.2 -98.8 14.1 45.1 -7.1 14.6 90 91 A F S < S+ 0 0 42 -3,-2.2 115,-0.5 1,-0.3 116,-0.5 0.798 78.8 129.5 63.9 30.5 43.7 -5.8 11.3 91 92 A N - 0 0 18 112,-0.2 -4,-2.7 113,-0.1 2,-0.3 -0.800 36.6-175.6 -99.6 160.7 43.1 -2.3 12.6 92 93 A G E -GI 86 202B 0 110,-1.7 110,-2.8 -2,-0.3 2,-0.5 -0.943 30.7-119.8-150.9 161.2 44.4 0.6 10.6 93 94 A I E +GI 85 201B 0 -8,-1.9 -9,-1.9 -2,-0.3 -8,-1.8 -0.970 39.9 167.9-100.4 128.2 44.9 4.3 10.3 94 95 A K + 0 0 2 106,-2.2 -11,-0.1 -2,-0.5 6,-0.0 -0.873 40.0 70.2-126.4 171.0 43.3 5.9 7.2 95 96 A G > + 0 0 0 -2,-0.3 3,-2.2 36,-0.1 5,-0.3 0.470 47.2 131.4 105.3 0.4 42.6 9.5 6.1 96 97 A G T 3 S+ 0 0 20 1,-0.3 -2,-0.0 2,-0.1 34,-0.0 0.796 81.1 49.3 -50.0 -28.1 46.1 10.7 5.2 97 98 A G T 3 S- 0 0 55 -72,-0.1 -1,-0.3 0, 0.0 -71,-0.0 0.422 123.0-106.8 -94.9 2.8 44.6 11.9 1.9 98 99 A G S < S+ 0 0 6 -3,-2.2 3,-0.3 -45,-0.0 69,-0.3 0.373 94.1 103.8 98.5 -5.7 41.7 13.7 3.6 99 100 A A > + 0 0 14 1,-0.2 4,-3.0 2,-0.1 5,-0.3 0.183 34.1 124.3-102.4 22.7 38.9 11.2 2.7 100 101 A L H > S+ 0 0 0 -5,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.750 71.5 53.3 -53.6 -37.9 38.5 9.4 6.1 101 102 A L H > S+ 0 0 4 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.977 115.2 36.5 -67.6 -58.4 34.7 10.2 6.4 102 103 A M H > S+ 0 0 19 -50,-0.2 4,-2.7 1,-0.2 5,-0.3 0.871 116.0 57.1 -61.5 -33.7 33.5 8.8 3.0 103 104 A E H X S+ 0 0 5 -4,-3.0 4,-2.7 -51,-0.3 -1,-0.2 0.913 111.1 42.0 -60.2 -42.6 36.1 6.0 3.3 104 105 A K H X S+ 0 0 11 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.887 113.7 51.8 -72.5 -35.9 34.5 4.9 6.7 105 106 A I H X S+ 0 0 14 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.951 115.7 41.3 -63.2 -48.3 30.9 5.4 5.4 106 107 A V H >< S+ 0 0 0 -4,-2.7 3,-0.6 1,-0.2 4,-0.2 0.939 114.0 53.6 -67.2 -40.0 31.7 3.2 2.2 107 108 A G H >< S+ 0 0 5 -4,-2.7 3,-1.4 -5,-0.3 -1,-0.2 0.865 105.4 53.9 -59.1 -44.2 33.7 0.7 4.4 108 109 A T H 3< S+ 0 0 85 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.837 110.2 46.9 -62.0 -32.7 30.8 0.2 6.8 109 110 A L T << S+ 0 0 26 -4,-1.1 -33,-1.9 -3,-0.6 2,-0.4 0.378 91.9 106.4 -91.4 7.8 28.5 -0.7 4.0 110 111 A T E < -d 76 0A 16 -3,-1.4 3,-0.3 -4,-0.2 -33,-0.2 -0.700 51.8-161.9-100.4 134.5 30.9 -3.2 2.3 111 112 A K E S+ 0 0 126 -35,-2.9 2,-0.6 -2,-0.4 -33,-0.2 0.918 92.1 27.2 -72.6 -44.3 30.4 -7.0 2.4 112 113 A D E S-d 78 0A 37 -35,-1.6 -33,-1.9 -36,-0.4 2,-0.6 -0.853 80.3-172.4-124.9 97.4 34.0 -7.8 1.4 113 114 A Y E -d 79 0A 2 -2,-0.6 94,-3.0 -3,-0.3 95,-1.2 -0.812 6.6-177.4 -98.9 121.5 36.2 -5.0 2.6 114 115 A I E -de 80 208A 0 -35,-3.0 -33,-2.3 -2,-0.6 2,-0.5 -0.953 18.4-158.3-124.3 135.8 39.9 -5.2 1.4 115 116 A W E -de 81 209A 0 93,-2.0 95,-3.1 -2,-0.4 2,-0.5 -0.940 10.1-166.5-105.7 137.7 42.9 -3.0 2.0 116 117 A V E + e 0 210A 1 -35,-2.2 -87,-0.5 -2,-0.5 -88,-0.3 -0.987 26.0 143.8-127.6 121.5 45.7 -3.3 -0.6 117 118 A V E - 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