==== 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 OXIDOREDUCTASE 13-OCT-08 3EVK . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [FE]; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROBACULUM AEROPHILUM; . AUTHOR S.LEE . 844 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27063.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 606 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 3 0.4 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 . 49 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 352 41.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.8 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 4 0 0 0 4 4 0 4 4 4 0 0 0 0 0 0 2 6 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 . 12 0 0 0 0 4 0 4 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 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 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 12 A S 0 0 138 0, 0.0 2,-0.4 0, 0.0 744,-0.3 0.000 360.0 360.0 360.0 130.9 117.3 77.8 -49.2 2 13 A V + 0 0 16 742,-0.1 2,-0.3 743,-0.1 741,-0.2 -0.993 360.0 173.8-125.9 132.6 115.8 78.2 -45.7 3 14 A T - 0 0 60 739,-1.2 2,-0.4 -2,-0.4 742,-0.1 -0.994 14.7-168.9-134.6 145.3 112.7 76.4 -44.4 4 15 A T - 0 0 16 -2,-0.3 2,-0.5 773,-0.1 -2,-0.0 -0.968 27.1-125.3-120.3 147.6 110.9 76.1 -41.1 5 16 A K - 0 0 87 -2,-0.4 2,-0.2 1,-0.0 770,-0.1 -0.803 29.4-140.2 -88.9 129.6 108.2 73.5 -40.5 6 17 A R - 0 0 88 -2,-0.5 2,-0.3 1,-0.0 34,-0.0 -0.504 8.6-125.5 -92.2 162.1 105.0 75.2 -39.2 7 18 A Y - 0 0 4 33,-0.3 2,-0.3 -2,-0.2 37,-0.1 -0.718 18.9-163.3-107.3 152.1 102.6 73.9 -36.5 8 19 A T - 0 0 96 -2,-0.3 29,-0.0 36,-0.0 33,-0.0 -0.950 28.4-105.5-132.7 153.7 98.8 73.3 -36.7 9 20 A L - 0 0 41 -2,-0.3 28,-0.1 28,-0.0 23,-0.0 -0.691 36.4-138.8 -75.2 121.9 96.1 72.9 -34.1 10 21 A P - 0 0 41 0, 0.0 2,-0.0 0, 0.0 -1,-0.0 -0.578 21.6-110.3 -78.6 147.9 95.0 69.2 -33.9 11 22 A P - 0 0 113 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.365 38.6 -98.6 -66.0 155.3 91.3 68.4 -33.6 12 23 A L - 0 0 26 2,-0.1 4,-0.1 1,-0.1 68,-0.0 -0.430 24.5-127.4 -64.4 150.4 90.1 67.0 -30.3 13 24 A P S S+ 0 0 80 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.475 90.2 19.8 -76.2 -0.3 89.7 63.2 -30.3 14 25 A Y S S- 0 0 32 73,-0.0 -2,-0.1 1,-0.0 5,-0.1 -0.927 98.9 -65.8-156.7 172.3 86.1 63.8 -29.0 15 26 A A > - 0 0 57 -2,-0.3 3,-1.9 1,-0.1 4,-0.2 -0.285 47.5-111.9 -65.0 152.7 83.3 66.3 -28.6 16 27 A Y T 3 S+ 0 0 80 1,-0.3 3,-0.4 2,-0.1 12,-0.3 0.808 120.0 45.8 -52.1 -33.1 83.7 69.4 -26.4 17 28 A N T > S+ 0 0 92 1,-0.2 3,-1.3 2,-0.1 -1,-0.3 0.332 83.6 100.7 -94.9 7.1 81.1 68.0 -24.0 18 29 A A T < S+ 0 0 21 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.671 79.3 50.7 -71.9 -18.8 82.6 64.5 -23.9 19 30 A L T >> S+ 0 0 0 -3,-0.4 4,-1.2 4,-0.3 3,-1.1 0.317 91.7 162.9-101.3 8.5 84.4 64.9 -20.6 20 31 A E T <4 + 0 0 88 -3,-1.3 4,-0.1 1,-0.3 -3,-0.0 -0.408 52.6 22.0 -69.3 148.4 81.4 66.2 -18.7 21 32 A P T 34 S+ 0 0 92 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 -0.988 125.3 52.8 -87.1 4.5 80.7 66.5 -15.8 22 33 A Y T <4 S+ 0 0 58 -3,-1.1 2,-0.4 1,-0.3 -2,-0.2 0.830 125.9 14.7 -74.5 -35.3 84.4 66.4 -14.9 23 34 A I S < S- 0 0 4 -4,-1.2 -1,-0.3 -6,-0.1 -4,-0.3 -0.969 91.3-121.8-138.7 124.8 85.5 69.2 -17.3 24 35 A S > - 0 0 22 -2,-0.4 4,-2.5 -3,-0.2 5,-0.2 -0.232 14.3-122.1 -69.6 152.8 82.8 71.4 -18.8 25 36 A A H > S+ 0 0 23 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.819 114.0 59.9 -56.8 -33.3 82.2 71.8 -22.6 26 37 A E H > S+ 0 0 93 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.925 107.9 42.7 -63.9 -46.2 82.8 75.6 -22.0 27 38 A I H > S+ 0 0 3 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.950 113.5 51.9 -65.2 -49.0 86.3 74.9 -20.7 28 39 A M H X S+ 0 0 1 -4,-2.5 4,-2.2 -12,-0.3 5,-0.3 0.916 112.1 46.8 -55.9 -45.6 87.1 72.4 -23.4 29 40 A Q H X S+ 0 0 83 -4,-2.7 4,-2.7 2,-0.2 5,-0.5 0.959 117.9 39.9 -62.4 -53.4 86.0 74.8 -26.1 30 41 A L H X>S+ 0 0 27 -4,-2.4 4,-2.1 1,-0.2 5,-2.0 0.919 115.3 53.3 -60.1 -44.3 88.0 77.8 -24.8 31 42 A H H <>S+ 0 0 2 -4,-3.4 5,-2.7 -5,-0.2 -1,-0.2 0.903 121.5 28.9 -61.7 -43.9 91.0 75.7 -23.8 32 43 A H H <>S+ 0 0 13 -4,-2.2 5,-1.2 -5,-0.3 -2,-0.2 0.948 126.2 41.0 -80.8 -54.2 91.3 74.1 -27.3 33 44 A Q H <5S+ 0 0 88 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.775 132.7 18.4 -71.5 -31.0 89.9 76.8 -29.6 34 45 A K T X5S+ 0 0 107 -4,-2.1 4,-1.7 -5,-0.5 -3,-0.2 0.835 130.1 34.8-105.3 -57.9 91.5 79.8 -27.8 35 46 A H H >S+ 0 0 70 -4,-2.2 5,-2.8 2,-0.2 6,-1.2 0.875 112.1 47.7 -60.3 -40.2 113.7 85.9 -41.6 53 64 A F H ><5S+ 0 0 5 -4,-1.7 3,-0.6 4,-0.2 -2,-0.2 0.912 111.4 50.0 -64.7 -44.6 116.9 86.0 -39.5 54 65 A R H 3<5S+ 0 0 7 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.821 109.4 52.0 -63.0 -33.2 118.2 82.9 -41.3 55 66 A K H 3<5S- 0 0 104 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.708 112.8-120.3 -72.6 -21.8 117.4 84.4 -44.7 56 67 A G T <<5S+ 0 0 59 -4,-0.8 -3,-0.2 -3,-0.6 -2,-0.1 0.734 81.5 122.5 79.3 27.1 119.3 87.5 -43.7 57 68 A E S - 0 0 59 -2,-0.3 4,-2.2 1,-0.2 5,-0.3 -0.857 33.0-165.4 -88.8 93.7 117.0 89.5 -30.5 62 73 A I H > S+ 0 0 2 -2,-1.1 4,-2.3 1,-0.2 5,-0.2 0.873 81.3 50.9 -54.1 -44.9 118.0 85.8 -30.3 63 74 A R H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.936 111.5 47.7 -57.6 -48.0 117.2 85.4 -26.6 64 75 A A H > S+ 0 0 5 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.913 114.1 44.2 -63.5 -48.4 113.7 86.9 -26.9 65 76 A V H X S+ 0 0 7 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.881 114.3 49.5 -67.3 -39.4 112.6 84.9 -29.8 66 77 A L H X S+ 0 0 2 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.872 110.4 50.9 -69.3 -35.9 114.0 81.6 -28.4 67 78 A R H X S+ 0 0 17 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.931 113.3 46.3 -58.2 -47.1 112.3 82.3 -25.1 68 79 A D H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.917 112.9 49.1 -61.6 -49.4 109.0 82.9 -27.1 69 80 A L H X S+ 0 0 1 -4,-3.0 4,-3.2 1,-0.2 5,-0.4 0.941 110.0 51.1 -55.1 -50.9 109.5 79.7 -29.1 70 81 A S H X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.902 112.4 46.8 -54.6 -45.0 110.2 77.6 -26.1 71 82 A F H X S+ 0 0 11 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.959 120.1 35.8 -63.1 -52.8 107.1 78.8 -24.3 72 83 A H H X S+ 0 0 33 -4,-2.3 4,-2.4 2,-0.2 -29,-0.2 0.870 114.5 54.4 -74.9 -40.4 104.7 78.4 -27.2 73 84 A L H X S+ 0 0 0 -4,-3.2 4,-2.8 -5,-0.3 -1,-0.2 0.937 112.0 46.6 -58.0 -47.8 106.2 75.3 -28.7 74 85 A N H X S+ 0 0 0 -4,-1.9 4,-2.9 -5,-0.4 5,-0.3 0.867 108.8 54.0 -62.8 -39.5 105.9 73.6 -25.3 75 86 A G H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.935 112.7 45.5 -56.3 -46.0 102.3 74.8 -24.9 76 87 A H H X S+ 0 0 4 -4,-2.4 4,-2.3 -37,-0.2 -2,-0.2 0.948 115.4 45.3 -62.5 -51.5 101.5 73.2 -28.3 77 88 A I H X S+ 0 0 0 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.933 115.3 46.1 -59.6 -51.1 103.3 69.9 -27.5 78 89 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 3,-0.3 0.892 114.5 46.8 -63.9 -41.7 101.9 69.5 -24.0 79 90 A H H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.874 107.0 58.7 -65.9 -35.9 98.3 70.3 -25.1 80 91 A S H < S+ 0 0 23 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.794 114.0 38.1 -62.5 -30.2 98.8 67.9 -28.0 81 92 A I H X S+ 0 0 0 -4,-1.3 4,-1.5 -3,-0.3 -2,-0.2 0.833 110.1 63.0 -81.9 -39.0 99.5 65.1 -25.4 82 93 A F H < S+ 0 0 1 -4,-2.6 4,-0.4 1,-0.2 -2,-0.2 0.891 98.9 52.5 -56.3 -46.6 96.8 66.4 -23.0 83 94 A W T >< S+ 0 0 2 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.948 114.1 38.9 -62.4 -54.2 93.8 65.9 -25.2 84 95 A P T 34 S+ 0 0 31 0, 0.0 -1,-0.2 0, 0.0 110,-0.2 0.673 102.8 73.2 -69.4 -15.6 94.4 62.2 -26.1 85 96 A N T 3< S+ 0 0 0 -4,-1.5 106,-3.4 -3,-0.2 2,-0.3 0.600 99.7 58.1 -64.5 -14.1 95.6 61.6 -22.5 86 97 A M B < +A 190 0A 2 -3,-1.4 104,-0.2 -4,-0.4 101,-0.0 -0.822 64.6 178.6-118.9 157.4 91.8 61.9 -21.7 87 98 A A - 0 0 2 102,-2.5 3,-0.1 -2,-0.3 -73,-0.0 -0.984 42.1 -79.9-153.8 152.7 88.8 60.0 -22.9 88 99 A P S >> S- 0 0 50 0, 0.0 4,-2.8 0, 0.0 3,-1.1 -0.254 70.6 -79.4 -53.2 141.1 85.0 60.0 -22.3 89 100 A P B 34 S+b 92 0B 63 0, 0.0 2,-0.3 0, 0.0 4,-0.2 -0.156 123.5 39.0 -45.4 130.5 84.2 58.2 -19.0 90 101 A G T 34 S+ 0 0 77 2,-2.4 99,-0.0 98,-0.3 0, 0.0 -0.653 125.0 37.7 119.4 -71.6 84.2 54.5 -19.8 91 102 A K T <4 S+ 0 0 133 -3,-1.1 101,-0.4 -2,-0.3 102,-0.4 0.825 124.4 55.7 -70.9 -34.4 87.2 54.6 -22.1 92 103 A G B < S+b 89 0B 5 -4,-2.8 -2,-2.4 99,-0.2 99,-0.2 -0.646 96.7 23.6 -93.8 155.3 88.5 57.2 -19.6 93 104 A G + 0 0 15 97,-2.4 99,-0.3 -2,-0.2 95,-0.2 -0.347 69.2 83.5 95.1-170.8 88.9 56.7 -15.9 94 105 A G S S- 0 0 57 -2,-0.1 -1,-0.2 98,-0.0 96,-0.1 -0.102 86.7 -41.9 65.2-166.4 89.4 53.7 -13.5 95 106 A K - 0 0 121 1,-0.1 97,-0.1 97,-0.0 2,-0.1 -0.573 61.8-106.2 -92.6 155.1 92.7 52.1 -12.8 96 107 A P - 0 0 17 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.385 33.2-172.0 -72.0 159.5 95.5 51.3 -15.3 97 108 A G >> + 0 0 45 -2,-0.1 4,-1.2 95,-0.1 3,-0.6 -0.708 44.7 34.1-131.3-171.4 96.3 47.8 -16.6 98 109 A G H 3> S- 0 0 51 -2,-0.2 4,-1.7 1,-0.2 3,-0.1 -0.212 118.7 -20.4 65.4-149.6 99.1 46.2 -18.7 99 110 A K H 3> S+ 0 0 101 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.814 135.5 57.6 -64.3 -34.4 102.7 47.5 -18.7 100 111 A I H <> S+ 0 0 1 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.901 106.5 48.7 -66.3 -40.9 101.8 50.9 -17.3 101 112 A A H X S+ 0 0 15 -4,-1.2 4,-2.6 2,-0.2 -2,-0.2 0.937 113.7 47.3 -60.2 -48.2 100.1 49.3 -14.2 102 113 A D H X S+ 0 0 94 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.904 114.0 45.4 -60.5 -46.6 103.2 47.1 -13.6 103 114 A L H X S+ 0 0 19 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.838 112.3 51.9 -69.0 -35.3 105.7 49.9 -14.0 104 115 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 5,-0.3 0.930 112.0 46.8 -63.9 -46.0 103.7 52.2 -11.8 105 116 A N H X S+ 0 0 67 -4,-2.6 4,-1.3 3,-0.2 -2,-0.2 0.880 112.3 52.3 -60.6 -38.3 103.6 49.4 -9.2 106 117 A K H < S+ 0 0 94 -4,-2.2 533,-0.9 1,-0.2 -2,-0.2 0.934 121.6 26.8 -63.1 -51.4 107.4 48.9 -9.6 107 118 A F H < S+ 0 0 0 -4,-2.3 -2,-0.2 531,-0.2 -1,-0.2 0.722 134.2 30.6 -90.6 -24.8 108.5 52.5 -9.1 108 119 A F H < S- 0 0 0 -4,-2.4 2,-1.0 -5,-0.3 -3,-0.2 0.422 96.8-123.4-116.4 -2.9 105.7 53.9 -6.9 109 120 A G S < S+ 0 0 23 -4,-1.3 2,-0.3 528,-0.5 -4,-0.1 -0.368 81.7 1.8 92.1 -54.7 104.6 50.8 -4.9 110 121 A S S > S- 0 0 34 -2,-1.0 4,-2.1 -6,-0.2 5,-0.1 -0.952 73.6-104.3-154.0 166.9 101.0 50.9 -6.0 111 122 A F H > S+ 0 0 17 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.873 119.9 58.7 -63.5 -36.6 98.5 52.9 -8.1 112 123 A E H > S+ 0 0 115 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.920 108.5 43.4 -60.3 -45.2 97.2 54.5 -4.9 113 124 A K H > S+ 0 0 36 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.894 114.2 50.3 -67.4 -41.7 100.7 55.9 -4.0 114 125 A F H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.926 109.8 51.1 -60.0 -45.4 101.3 57.0 -7.6 115 126 A K H X S+ 0 0 83 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.903 111.9 47.5 -58.4 -43.0 97.9 58.7 -7.7 116 127 A E H X S+ 0 0 88 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.923 114.3 45.9 -63.8 -48.2 98.7 60.5 -4.4 117 128 A E H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.927 115.7 44.7 -61.5 -48.1 102.2 61.6 -5.6 118 129 A F H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.898 114.8 49.4 -64.2 -43.1 100.9 62.8 -9.0 119 130 A S H X S+ 0 0 6 -4,-2.5 4,-2.8 -5,-0.3 -1,-0.2 0.893 112.0 47.8 -62.8 -42.8 98.0 64.6 -7.5 120 131 A Q H X S+ 0 0 73 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.910 110.2 51.6 -68.5 -40.0 100.1 66.3 -4.9 121 132 A A H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.926 114.0 45.2 -59.8 -43.7 102.7 67.4 -7.5 122 133 A A H >< S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.925 113.3 48.4 -64.7 -46.0 99.8 68.9 -9.6 123 134 A K H 3< S+ 0 0 56 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.787 111.7 51.6 -67.2 -26.4 98.1 70.6 -6.6 124 135 A N T 3< S+ 0 0 58 -4,-1.9 2,-0.3 -5,-0.2 -1,-0.3 0.146 71.9 129.1-103.5 17.9 101.4 72.1 -5.5 125 136 A V < - 0 0 6 -3,-1.3 2,-0.6 2,-0.1 4,-0.1 -0.619 60.4-129.7 -65.9 129.6 102.5 73.7 -8.7 126 137 A E S S- 0 0 9 -2,-0.3 2,-0.3 2,-0.1 -2,-0.1 -0.774 73.2 -21.0 -86.9 120.3 103.4 77.3 -7.9 127 138 A G S S- 0 0 5 -2,-0.6 2,-0.3 21,-0.1 -2,-0.1 -0.618 121.6 -20.7 77.9-139.6 101.6 79.6 -10.3 128 139 A V S S+ 0 0 5 -2,-0.3 21,-2.5 39,-0.1 2,-0.3 -0.728 86.5 93.7-104.4 152.9 100.6 77.9 -13.5 129 140 A G E -C 148 0C 0 -2,-0.3 37,-2.8 19,-0.3 38,-0.4 -0.972 55.8 -77.4 166.8-149.4 102.0 74.7 -15.0 130 141 A W E -CD 147 165C 0 17,-2.4 17,-2.9 -2,-0.3 2,-0.4 -0.949 13.6-136.5-142.4 152.6 101.7 71.0 -15.3 131 142 A A E -CD 146 164C 0 33,-1.9 33,-2.9 -2,-0.3 2,-0.3 -0.972 36.1-175.9-104.6 136.1 102.3 67.7 -13.5 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F H X S+ 0 0 10 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.935 119.8 37.1 -61.6 -52.7 118.0 91.9 -15.2 284 83 B H H X S+ 0 0 35 -4,-2.2 4,-2.7 2,-0.2 -29,-0.2 0.864 114.3 53.7 -74.5 -38.1 120.6 94.7 -15.8 285 84 B L H X S+ 0 0 0 -4,-3.0 4,-2.7 -5,-0.3 -1,-0.2 0.939 113.5 44.7 -59.9 -46.5 119.0 97.4 -13.6 286 85 B N H X S+ 0 0 0 -4,-1.8 4,-2.7 -5,-0.4 5,-0.3 0.867 109.6 55.2 -64.6 -40.4 119.1 94.9 -10.7 287 86 B G H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 5,-0.2 0.962 113.2 43.4 -51.4 -51.2 122.7 93.9 -11.7 288 87 B H H X S+ 0 0 6 -4,-2.7 4,-1.6 -37,-0.2 -2,-0.2 0.891 115.0 47.2 -64.0 -45.6 123.6 97.5 -11.4 289 88 B I H X S+ 0 0 1 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.939 114.7 45.6 -62.9 -48.3 121.7 98.2 -8.1 290 89 B L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.878 113.0 48.1 -68.5 -41.1 123.0 95.1 -6.3 291 90 B H H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.851 107.8 58.0 -65.2 -32.7 126.6 95.6 -7.3 292 91 B S H < S+ 0 0 22 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.834 113.1 38.3 -65.6 -35.0 126.3 99.2 -6.2 293 92 B I H X S+ 0 0 1 -4,-1.4 4,-1.6 2,-0.1 -2,-0.2 0.820 110.0 64.7 -78.6 -36.9 125.3 98.1 -2.7 294 93 B F H < S+ 0 0 1 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.880 98.0 51.7 -54.7 -47.2 127.8 95.2 -2.8 295 94 B W T >< S+ 0 0 2 -4,-1.8 3,-1.6 1,-0.2 -1,-0.2 0.955 114.5 38.6 -63.7 -54.4 131.0 97.3 -2.9 296 95 B P T 34 S+ 0 0 30 0, 0.0 110,-0.3 0, 0.0 -1,-0.2 0.715 102.5 73.6 -71.8 -17.4 130.3 99.6 0.1 297 96 B N T 3< S+ 0 0 0 -4,-1.6 106,-4.0 109,-0.1 2,-0.3 0.595 101.2 56.1 -58.4 -16.3 128.8 96.6 1.9 298 97 B M B < +K 402 0E 2 -3,-1.6 104,-0.2 104,-0.3 7,-0.1 -0.839 63.6 174.7-121.3 160.7 132.5 95.6 2.2 299 98 B A - 0 0 9 102,-2.2 5,-0.2 5,-0.4 3,-0.1 -0.972 45.0 -70.5-158.7 153.3 135.7 97.2 3.5 300 99 B P S > S- 0 0 41 0, 0.0 4,-0.9 0, 0.0 -69,-0.2 -0.170 72.2 -78.2 -49.1 141.5 139.3 96.3 4.1 301 100 B P T 4 S+ 0 0 54 0, 0.0 2,-1.8 0, 0.0 4,-0.2 -0.097 117.7 6.0 -41.5 132.9 139.9 93.7 6.9 302 101 B G T 4 S+ 0 0 78 98,-0.5 3,-0.3 1,-0.2 4,-0.1 -0.477 116.5 77.3 85.7 -64.0 139.7 95.4 10.4 303 102 B K T 4 S- 0 0 177 -2,-1.8 -1,-0.2 1,-0.3 2,-0.1 0.642 125.5 -15.4 -50.7 -17.0 138.6 98.7 8.8 304 103 B G S < S+ 0 0 10 -4,-0.9 -5,-0.4 -5,-0.2 -1,-0.3 -0.494 103.1 84.8 174.2 125.5 135.4 96.8 8.6 305 104 B G + 0 0 13 -3,-0.3 97,-0.2 -4,-0.2 98,-0.1 0.528 59.4 91.0 148.2 40.9 134.4 93.1 8.9 306 105 B G S S- 0 0 53 1,-0.3 96,-0.1 96,-0.3 95,-0.1 0.466 86.3 -31.1-113.6-107.2 133.9 91.8 12.5 307 106 B K - 0 0 132 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.898 65.2-103.3-116.6 153.5 130.6 91.8 14.3 308 107 B P - 0 0 16 0, 0.0 2,-0.2 0, 0.0 15,-0.1 -0.355 36.8-171.3 -70.6 155.1 127.7 94.2 13.9 309 108 B G > + 0 0 42 95,-0.1 4,-2.1 -2,-0.0 3,-0.5 -0.620 44.7 18.5-126.2-171.8 127.0 97.0 16.5 310 109 B G H > S- 0 0 50 1,-0.2 4,-1.9 -2,-0.2 5,-0.1 0.010 121.8 -13.9 51.7-144.4 124.3 99.5 17.2 311 110 B K H > S+ 0 0 94 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.849 134.7 56.6 -62.4 -40.3 120.8 99.1 15.7 312 111 B I H > S+ 0 0 1 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.920 109.3 46.8 -59.9 -43.9 121.8 96.4 13.2 313 112 B A H X 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