==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM-BINDING PROTEIN 30-JUL-93 2SAS . COMPND 2 MOLECULE: SARCOPLASMIC CALCIUM-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BRANCHIOSTOMA LANCEOLATUM; . AUTHOR W.J.COOK,Y.S.BABU,J.A.COX . 185 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9567.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 73.5 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 . 3 1.6 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 . 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 . 10 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 48.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.7 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 1 0 1 0 0 1 2 1 1 0 0 0 0 0 0 1 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 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 106 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-154.2 19.4 -7.9 36.0 2 2 A L - 0 0 17 2,-0.0 2,-0.1 3,-0.0 85,-0.0 -0.893 360.0-121.0-114.7 150.8 20.3 -6.4 32.6 3 3 A N > - 0 0 66 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.381 32.7 -95.2 -85.1-179.7 23.5 -7.7 31.0 4 4 A D H > S+ 0 0 128 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.913 124.6 51.6 -54.1 -56.7 26.4 -5.5 30.1 5 5 A F H > S+ 0 0 39 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.835 109.1 50.1 -48.7 -50.9 25.3 -5.1 26.5 6 6 A Q H > S+ 0 0 13 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 111.6 48.3 -57.7 -46.1 21.8 -4.1 27.5 7 7 A K H X S+ 0 0 73 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.770 106.4 58.2 -66.3 -29.4 23.2 -1.5 29.9 8 8 A Q H X S+ 0 0 120 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.887 109.7 42.4 -65.9 -46.4 25.4 -0.1 27.2 9 9 A K H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.781 111.9 55.1 -73.9 -35.2 22.5 0.6 24.9 10 10 A I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.926 108.1 48.4 -64.5 -43.5 20.4 2.0 27.8 11 11 A K H X S+ 0 0 75 -4,-2.1 4,-2.7 1,-0.2 3,-0.3 0.975 107.2 59.7 -57.0 -48.2 23.3 4.4 28.6 12 12 A F H X S+ 0 0 26 -4,-2.1 4,-2.2 1,-0.3 5,-0.5 0.872 107.5 42.2 -46.2 -54.3 23.2 5.2 24.8 13 13 A T H X>S+ 0 0 0 -4,-1.9 4,-1.1 2,-0.2 5,-0.6 0.809 112.3 54.6 -66.4 -31.6 19.6 6.4 24.9 14 14 A F H X>S+ 0 0 1 -4,-2.1 5,-2.9 -3,-0.3 4,-1.5 0.999 117.3 37.3 -60.8 -56.8 20.1 8.3 28.2 15 15 A D H <5S+ 0 0 40 -4,-2.7 -2,-0.2 3,-0.2 7,-0.2 0.704 128.8 26.4 -63.2 -42.0 23.0 10.2 26.6 16 16 A F H <5S+ 0 0 57 -4,-2.2 -3,-0.2 -5,-0.2 -1,-0.2 0.660 127.8 37.2-100.6 -30.3 21.9 10.8 23.0 17 17 A F H <5S+ 0 0 2 -4,-1.1 -3,-0.2 -5,-0.5 -2,-0.2 0.647 132.4 10.1-103.1 -12.8 18.2 10.8 23.2 18 18 A L T < < + 0 0 3 -5,-2.9 3,-1.5 -6,-0.2 5,-0.1 -0.554 54.7 163.1 -81.9 71.4 20.4 14.2 28.3 20 20 A M T 3 S+ 0 0 21 -2,-2.0 -1,-0.2 1,-0.3 10,-0.1 0.870 73.3 46.6 -59.4 -41.1 20.8 17.0 25.7 21 21 A N T 3 S- 0 0 44 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.250 105.3-129.3 -86.5 4.4 22.9 19.2 28.0 22 22 A H < + 0 0 135 -3,-1.5 -2,-0.1 -7,-0.2 4,-0.1 0.763 64.4 128.9 56.9 43.2 25.2 16.4 29.1 23 23 A D S S- 0 0 79 2,-0.5 -1,-0.1 0, 0.0 3,-0.1 0.406 80.0-105.1-110.7 8.4 25.1 16.6 32.9 24 24 A G S S+ 0 0 41 1,-0.2 55,-0.8 -5,-0.1 2,-0.3 0.611 94.1 86.4 83.7 10.2 24.3 13.0 33.7 25 25 A S E S-A 78 0A 24 53,-0.2 -2,-0.5 54,-0.1 2,-0.4 -0.973 71.1-134.2-142.6 147.7 20.8 13.8 34.6 26 26 A I E +A 77 0A 0 51,-2.5 51,-3.1 -2,-0.3 2,-0.3 -0.847 42.0 152.3 -97.5 132.0 17.5 14.2 32.7 27 27 A Q >> - 0 0 53 -2,-0.4 3,-2.6 -9,-0.2 4,-0.8 -0.896 62.2 -89.2-156.0 161.6 15.6 17.3 33.8 28 28 A D H >> S+ 0 0 70 47,-0.4 4,-2.2 1,-0.3 3,-0.5 0.802 123.0 65.8 -45.5 -40.0 13.1 19.8 32.2 29 29 A N H 3> S+ 0 0 55 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.756 95.3 56.5 -56.4 -27.8 16.1 21.8 30.9 30 30 A D H <> S+ 0 0 0 -3,-2.6 4,-0.6 2,-0.2 -1,-0.3 0.923 109.0 46.7 -66.7 -46.1 17.1 18.8 28.7 31 31 A F H < S+ 0 0 45 -4,-1.9 3,-3.0 -5,-0.2 4,-0.3 0.605 76.2 162.3 -92.0 -22.4 13.2 25.0 11.6 43 43 A K G >< S- 0 0 143 -4,-2.6 3,-1.3 1,-0.3 -1,-0.1 0.086 74.2 -7.9 37.2-127.0 13.0 28.7 12.4 44 44 A G G 3 S+ 0 0 77 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.414 114.0 90.7 -72.8 1.3 10.0 30.4 10.6 45 45 A S G < S+ 0 0 103 -3,-3.0 2,-0.3 2,-0.1 -1,-0.3 0.741 91.3 49.2 -68.0 -22.1 9.3 27.2 8.6 46 46 A L S < S- 0 0 38 -3,-1.3 2,-0.1 -4,-0.3 3,-0.0 -0.879 91.2-121.4-112.8 147.9 7.0 26.3 11.5 47 47 A S > - 0 0 61 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.358 29.2-104.3 -82.8 170.4 4.4 28.6 13.0 48 48 A D H >> S+ 0 0 112 1,-0.3 4,-2.5 2,-0.2 3,-0.5 0.962 123.4 54.7 -56.4 -52.5 4.2 29.7 16.7 49 49 A A H 3> S+ 0 0 59 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.870 103.2 55.7 -51.3 -40.5 1.3 27.2 17.2 50 50 A D H 3> S+ 0 0 72 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.879 109.0 46.4 -62.9 -40.4 3.5 24.3 15.8 51 51 A Y H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 3,-1.8 0.966 114.4 47.8 -70.6 -55.0 9.1 10.0 32.5 66 66 A K H 3X S+ 0 0 46 -4,-3.7 4,-2.1 1,-0.3 -2,-0.2 0.876 110.0 53.9 -47.9 -49.4 9.4 12.0 35.8 67 67 A G H 3< S+ 0 0 68 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.502 116.8 37.1 -68.1 -4.4 6.4 10.3 37.3 68 68 A R H <4 S+ 0 0 86 -3,-1.8 -2,-0.2 -4,-0.2 -1,-0.2 0.661 127.2 27.5-117.1 -30.0 7.8 6.8 36.6 69 69 A A H < S+ 0 0 2 -4,-2.1 2,-1.8 1,-0.1 9,-0.2 0.648 91.3 92.0-113.5 -20.6 11.5 7.1 37.3 70 70 A D >< + 0 0 11 -4,-2.1 3,-1.1 -5,-0.4 5,-0.1 -0.583 47.7 170.5 -82.2 86.8 11.9 9.9 39.8 71 71 A I T 3 S+ 0 0 125 -2,-1.8 -1,-0.2 1,-0.3 6,-0.1 0.857 73.6 41.0 -64.0 -43.6 11.8 7.7 42.9 72 72 A N T 3 S- 0 0 97 -3,-0.2 -1,-0.3 2,-0.0 -2,-0.1 0.011 105.8-121.5 -94.4 21.6 12.8 10.4 45.5 73 73 A K < + 0 0 167 -3,-1.1 -2,-0.1 -7,-0.2 -3,-0.1 0.604 69.9 129.0 44.0 41.3 10.7 13.2 44.0 74 74 A D S S- 0 0 77 2,-0.3 -1,-0.1 0, 0.0 -3,-0.1 -0.107 75.5-114.5-104.9 26.0 13.4 15.9 43.2 75 75 A D S S+ 0 0 96 -5,-0.1 2,-0.4 1,-0.1 -47,-0.4 0.650 86.6 105.0 47.9 22.9 12.4 16.5 39.5 76 76 A V - 0 0 31 -49,-0.1 2,-0.6 -10,-0.1 -2,-0.3 -0.996 59.9-152.7-126.5 130.9 15.7 15.1 38.3 77 77 A V E -A 26 0A 0 -51,-3.1 -51,-2.5 -2,-0.4 2,-0.2 -0.951 21.0-158.9-102.3 119.8 15.9 11.6 36.7 78 78 A S E > -A 25 0A 25 -2,-0.6 4,-2.6 -9,-0.2 -53,-0.2 -0.507 31.1-104.6 -91.7 174.6 19.4 10.3 37.4 79 79 A W H > S+ 0 0 52 -55,-0.8 4,-2.9 2,-0.2 5,-0.2 0.914 122.0 52.4 -55.6 -53.0 21.1 7.5 35.4 80 80 A E H > S+ 0 0 124 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.904 112.0 44.1 -54.7 -46.8 20.5 5.1 38.3 81 81 A E H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.908 114.4 50.5 -68.5 -35.8 16.7 5.8 38.4 82 82 A Y H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.854 111.3 48.6 -65.5 -37.4 16.6 5.7 34.6 83 83 A L H X S+ 0 0 30 -4,-2.9 4,-2.8 2,-0.2 5,-0.3 0.975 111.0 50.8 -65.4 -53.6 18.4 2.3 34.7 84 84 A A H X S+ 0 0 53 -4,-2.8 4,-1.9 1,-0.3 -2,-0.2 0.860 107.2 53.6 -47.7 -46.9 15.9 1.1 37.4 85 85 A M H X S+ 0 0 4 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.928 111.7 45.7 -58.4 -45.0 13.0 2.2 35.2 86 86 A W H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.4 0.894 108.1 54.7 -68.4 -38.4 14.5 0.1 32.3 87 87 A E H X S+ 0 0 75 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.871 109.0 51.3 -61.1 -36.8 15.1 -3.0 34.5 88 88 A K H X S+ 0 0 106 -4,-1.9 4,-0.7 -5,-0.3 -2,-0.2 0.985 115.1 39.0 -67.2 -57.6 11.5 -2.9 35.5 89 89 A T H >< S+ 0 0 12 -4,-2.2 3,-0.5 1,-0.2 4,-0.3 0.798 112.8 53.7 -66.0 -30.8 10.0 -2.7 32.0 90 90 A I H >< S+ 0 0 32 -4,-2.7 3,-0.9 1,-0.2 -1,-0.2 0.938 99.5 66.3 -66.6 -39.8 12.5 -5.1 30.3 91 91 A A H 3< S+ 0 0 79 -4,-1.5 -1,-0.2 -5,-0.4 -2,-0.2 0.798 122.9 10.5 -47.2 -32.9 11.5 -7.5 33.1 92 92 A T T << S+ 0 0 122 -4,-0.7 2,-0.3 -3,-0.5 -1,-0.3 -0.089 94.7 105.7-143.2 43.4 7.9 -7.6 31.5 93 93 A C < + 0 0 20 -3,-0.9 3,-0.1 -4,-0.3 6,-0.0 -0.930 28.8 177.7-123.2 150.5 7.4 -6.0 28.0 94 94 A K + 0 0 161 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.672 62.1 17.5-126.7 -18.8 6.8 -7.8 24.6 95 95 A S S > S- 0 0 48 1,-0.1 3,-2.5 71,-0.0 4,-0.4 -0.878 84.2 -94.5-144.0 171.7 6.2 -5.2 21.7 96 96 A V G > S+ 0 0 24 1,-0.3 3,-1.8 -2,-0.3 7,-0.1 0.883 122.2 69.4 -55.6 -38.4 6.7 -1.5 21.1 97 97 A A G 3 S+ 0 0 84 1,-0.3 -1,-0.3 -3,-0.0 4,-0.0 0.510 94.7 54.6 -56.8 -9.0 3.1 -1.2 22.3 98 98 A D G < S+ 0 0 92 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.484 80.8 109.2-100.2 -18.2 4.2 -2.2 25.9 99 99 A L S < S- 0 0 8 -3,-1.8 5,-0.1 -4,-0.4 67,-0.0 -0.274 85.5 -84.6 -56.5 153.9 6.9 0.5 26.4 100 100 A P >> - 0 0 7 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.315 43.3-109.7 -65.0 147.1 6.1 3.3 28.9 101 101 A A T >4 S+ 0 0 49 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.659 113.9 68.0 -48.0 -34.5 4.1 6.1 27.3 102 102 A W T >> S+ 0 0 2 1,-0.3 4,-1.2 2,-0.2 3,-1.0 0.775 97.6 58.2 -59.1 -30.0 6.9 8.6 27.4 103 103 A C H <> S+ 0 0 0 -3,-2.2 4,-3.2 1,-0.3 -1,-0.3 0.803 92.1 66.2 -64.5 -37.4 8.5 6.4 24.8 104 104 A Q H << S+ 0 0 79 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.596 109.6 38.8 -61.2 -16.8 5.5 6.8 22.5 105 105 A N H <> S+ 0 0 36 -3,-1.0 4,-1.3 -4,-0.4 -1,-0.2 0.687 112.8 54.5-104.6 -26.9 6.5 10.5 22.2 106 106 A R H X S+ 0 0 3 -4,-1.2 4,-2.8 2,-0.2 5,-0.2 0.927 104.2 57.3 -70.7 -46.5 10.3 9.8 22.1 107 107 A I H X S+ 0 0 3 -4,-3.2 4,-2.7 2,-0.2 -3,-0.1 0.909 111.6 37.6 -50.7 -59.6 9.9 7.4 19.1 108 108 A P H > S+ 0 0 28 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.849 115.9 54.5 -62.7 -36.9 8.1 9.8 16.7 109 109 A F H X S+ 0 0 40 -4,-1.3 4,-1.0 2,-0.2 -2,-0.2 0.932 112.2 43.0 -62.9 -48.7 10.2 12.8 17.8 110 110 A L H >X S+ 0 0 18 -4,-2.8 4,-0.6 2,-0.2 3,-0.5 0.937 114.6 51.1 -63.7 -44.5 13.4 10.9 17.1 111 111 A F H >X S+ 0 0 7 -4,-2.7 4,-2.4 -5,-0.2 3,-1.3 0.928 109.0 49.3 -60.6 -48.8 12.0 9.5 13.8 112 112 A K H 3< S+ 0 0 145 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.630 106.6 56.7 -65.7 -18.3 10.9 13.0 12.4 113 113 A G H << S+ 0 0 58 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.615 110.7 44.9 -86.5 -13.4 14.3 14.5 13.3 114 114 A M H << S+ 0 0 6 -3,-1.3 2,-3.1 -4,-0.6 -2,-0.2 0.875 100.2 68.3 -92.1 -47.1 15.9 11.8 11.1 115 115 A D >< + 0 0 12 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 -0.341 63.7 171.2 -70.2 66.7 13.5 12.2 8.2 116 116 A V T 3 S+ 0 0 116 -2,-3.1 -1,-0.2 1,-0.3 6,-0.1 0.763 71.7 55.1 -50.7 -25.9 14.8 15.7 7.3 117 117 A S T 3 S- 0 0 69 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.561 100.0-128.2 -90.5 -11.1 12.7 15.6 4.1 118 118 A G S < S+ 0 0 65 -3,-1.8 -2,-0.1 -6,-0.1 4,-0.1 0.450 74.3 114.8 82.2 3.7 9.2 14.9 5.5 119 119 A D S S- 0 0 92 2,-0.3 3,-0.1 1,-0.0 -1,-0.1 0.486 85.9-114.0 -85.6 -5.8 8.2 11.9 3.3 120 120 A G S S+ 0 0 29 1,-0.3 38,-0.4 -5,-0.2 2,-0.3 0.790 89.0 96.2 80.2 25.0 8.1 9.5 6.3 121 121 A I - 0 0 60 36,-0.2 2,-0.7 37,-0.1 -2,-0.3 -0.947 67.8-142.7-139.2 137.4 11.1 7.4 5.0 122 122 A V - 0 0 0 34,-2.0 34,-0.2 -2,-0.3 -7,-0.1 -0.974 29.1-160.3-105.2 116.3 14.6 8.0 6.3 123 123 A D > - 0 0 46 -2,-0.7 4,-2.5 32,-0.1 5,-0.1 -0.330 33.9 -89.0 -84.9-179.7 16.6 7.5 3.1 124 124 A L H > S+ 0 0 63 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.764 126.6 50.0 -56.9 -43.5 20.4 6.7 3.0 125 125 A E H > S+ 0 0 99 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.920 112.7 48.1 -66.5 -39.3 21.5 10.3 2.9 126 126 A E H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.942 113.0 48.2 -64.0 -44.2 19.2 11.1 5.9 127 127 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 3,-0.3 0.930 109.1 52.9 -59.9 -51.0 20.6 8.1 7.7 128 128 A Q H < S+ 0 0 75 -4,-2.9 4,-0.5 1,-0.3 -1,-0.2 0.811 110.2 48.6 -51.6 -38.2 24.2 9.2 6.8 129 129 A N H X S+ 0 0 73 -4,-1.6 4,-2.1 -3,-0.3 -1,-0.3 0.775 105.9 58.0 -72.4 -32.7 23.4 12.6 8.3 130 130 A Y H < S+ 0 0 10 -4,-1.7 6,-0.3 -3,-0.3 -2,-0.2 0.957 108.4 46.5 -61.3 -49.3 22.0 10.8 11.4 131 131 A a T < S+ 0 0 8 -4,-2.1 5,-0.4 4,-0.1 7,-0.3 0.585 119.2 40.8 -63.1 -27.0 25.4 9.2 11.8 132 132 A K T 4 S+ 0 0 147 -4,-0.5 2,-2.4 -5,-0.2 -2,-0.2 0.888 115.0 43.8 -90.4 -67.7 27.2 12.5 11.4 133 133 A N S < S+ 0 0 152 -4,-2.1 2,-0.2 2,-0.1 -1,-0.2 -0.443 120.6 48.7 -80.8 61.4 25.2 15.1 13.2 134 134 A F S S- 0 0 46 -2,-2.4 2,-1.3 -3,-0.3 -118,-0.0 -0.217 106.9-123.3 161.9 109.2 25.0 12.5 16.0 135 135 A Q + 0 0 143 -2,-0.2 -3,-0.2 2,-0.1 -4,-0.1 -0.270 54.4 150.6 -68.8 41.7 28.6 11.4 16.3 136 136 A L - 0 0 18 -2,-1.3 2,-1.6 -5,-0.4 46,-0.1 -0.432 54.0-113.7 -79.3 154.5 28.2 7.6 15.7 137 137 A Q + 0 0 158 44,-0.4 2,-1.5 -2,-0.1 -1,-0.1 -0.348 42.5 168.3 -87.3 62.8 30.8 5.3 14.1 138 138 A a + 0 0 22 -2,-1.6 3,-0.3 -7,-0.3 45,-0.1 -0.544 3.1 173.4 -73.5 88.4 29.2 4.4 10.8 139 139 A A S S+ 0 0 100 -2,-1.5 2,-0.3 1,-0.3 -1,-0.2 0.550 79.4 18.0 -76.2 -13.5 32.2 2.8 9.0 140 140 A D S > S- 0 0 79 1,-0.1 4,-1.2 2,-0.0 -1,-0.3 -0.775 72.7-175.5-153.0 94.3 30.1 1.6 5.9 141 141 A V H >> S+ 0 0 20 -2,-0.3 4,-3.1 -3,-0.3 3,-0.7 0.960 82.5 54.1 -67.8 -48.6 26.9 3.5 6.0 142 142 A P H 3> S+ 0 0 62 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.836 108.8 49.7 -51.4 -39.7 25.3 1.6 3.0 143 143 A A H 3> S+ 0 0 31 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.820 111.5 47.6 -70.4 -33.1 26.0 -1.7 4.8 144 144 A V H S+ 0 0 77 -4,-1.5 5,-1.6 -5,-0.3 4,-0.5 0.806 103.1 52.9 -73.8 -26.3 21.1 -2.6 4.3 147 147 A V H <5S+ 0 0 44 -4,-0.9 3,-0.3 -3,-0.4 -2,-0.2 0.935 113.4 46.1 -69.9 -42.6 20.6 -4.3 7.7 148 148 A I H <5S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.922 120.3 35.8 -63.6 -45.6 17.8 -1.8 8.4 149 149 A T H X>S- 0 0 9 -4,-2.4 5,-2.9 -5,-0.2 4,-0.9 0.492 106.1-130.6 -88.2 1.0 16.1 -2.1 5.0 150 150 A D T ><5S- 0 0 71 -4,-0.5 3,-0.6 -3,-0.3 -3,-0.2 0.886 74.2 -40.5 50.0 52.2 16.9 -5.8 5.0 151 151 A G T 34> S- 0 0 47 -2,-2.0 4,-2.7 -36,-0.2 3,-0.9 -0.487 71.8 -79.1-114.4-171.6 9.6 4.2 7.8 158 158 A L H 3> S+ 0 0 53 -38,-0.4 4,-2.6 1,-0.3 5,-0.2 0.869 129.6 51.8 -57.9 -42.5 8.0 4.9 11.3 159 159 A N H 3> S+ 0 0 93 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.722 112.4 46.8 -70.2 -19.8 6.9 1.3 11.7 160 160 A R H <> S+ 0 0 24 -3,-0.9 4,-1.8 2,-0.2 -2,-0.2 0.885 112.1 51.1 -81.4 -42.2 10.5 0.2 10.9 161 161 A Y H X S+ 0 0 0 -4,-2.7 4,-3.3 1,-0.2 3,-0.3 0.892 106.8 52.7 -53.1 -60.3 11.8 2.8 13.3 162 162 A K H X S+ 0 0 69 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.769 108.3 52.1 -43.7 -46.1 9.5 1.6 16.1 163 163 A E H X S+ 0 0 94 -4,-0.8 4,-1.6 -3,-0.2 -1,-0.2 0.861 113.3 43.0 -65.0 -45.2 10.8 -2.0 15.7 164 164 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 -3,-0.3 5,-0.2 0.898 110.7 54.0 -71.7 -41.6 14.4 -1.0 15.9 165 165 A Y H >X S+ 0 0 1 -4,-3.3 4,-2.0 1,-0.2 3,-0.5 0.968 109.4 51.4 -55.6 -47.3 13.9 1.4 18.8 166 166 A Y H 3X S+ 0 0 37 -4,-2.2 4,-2.3 1,-0.3 5,-0.2 0.841 111.3 45.8 -52.2 -47.3 12.3 -1.5 20.7 167 167 A R H 3X S+ 0 0 102 -4,-1.6 4,-1.6 2,-0.2 -1,-0.3 0.794 108.9 55.5 -71.9 -30.2 15.2 -3.8 20.0 168 168 A L H << S+ 0 0 0 -4,-2.2 -2,-0.2 -3,-0.5 -1,-0.2 0.824 113.9 41.6 -65.9 -42.5 17.7 -1.1 21.0 169 169 A L H < S+ 0 0 0 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.838 129.4 20.9 -76.6 -37.7 16.0 -0.8 24.3 170 170 A T H < S+ 0 0 16 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.813 81.0 109.0-113.5 -21.9 15.4 -4.5 25.1 171 171 A S < - 0 0 16 -4,-1.6 4,-0.1 -5,-0.2 -81,-0.0 -0.232 48.8-152.1 -65.2 140.9 17.4 -7.2 23.3 172 172 A P S S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 -167,-0.2 0.338 82.1 48.4 -86.9 4.6 19.9 -9.1 25.4 173 173 A A S S- 0 0 57 -168,-0.1 -2,-0.1 -167,-0.0 -3,-0.0 -0.996 97.6 -86.1-148.6 148.9 21.8 -9.6 22.1 174 174 A A + 0 0 55 -2,-0.3 2,-0.2 2,-0.1 -6,-0.1 -0.183 63.8 138.2 -55.8 120.7 23.2 -7.7 19.1 175 175 A D S > S- 0 0 24 -4,-0.1 3,-2.2 -8,-0.1 4,-0.1 -0.779 70.7 -57.9-147.1-169.2 20.5 -7.4 16.4 176 176 A A G > S+ 0 0 17 1,-0.3 3,-2.2 -2,-0.2 4,-0.2 0.658 120.2 75.1 -53.1 -27.5 19.1 -4.8 14.0 177 177 A G G > S+ 0 0 0 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.761 82.8 73.3 -61.9 -20.5 18.3 -2.4 16.9 178 178 A N G X >S+ 0 0 0 -3,-2.2 5,-1.8 1,-0.2 3,-1.5 0.719 76.4 77.1 -62.6 -21.7 22.0 -1.9 16.9 179 179 A T G X 5S+ 0 0 0 -3,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.688 82.4 66.2 -61.9 -23.0 21.7 0.2 13.6 180 180 A L G < 5S+ 0 0 0 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.607 98.7 50.4 -76.1 -14.2 20.5 3.1 15.5 181 181 A M G < 5S- 0 0 22 -3,-1.5 -44,-0.4 -4,-0.3 -1,-0.3 0.299 128.3-106.6-102.9 4.9 23.9 3.4 17.2 182 182 A G T < 5S+ 0 0 2 -3,-0.9 2,-0.3 1,-0.3 -43,-0.3 0.705 80.5 124.3 79.2 23.7 25.1 3.3 13.7 183 183 A Q < - 0 0 84 -5,-1.8 -1,-0.3 -6,-0.1 -2,-0.2 -0.836 60.7-121.6-121.0 156.6 26.5 -0.3 13.9 184 184 A K 0 0 84 -2,-0.3 -40,-0.1 -3,-0.1 -8,-0.1 -0.703 360.0 360.0 -86.4 141.6 26.0 -3.5 12.1 185 185 A P 0 0 99 0, 0.0 -9,-0.1 0, 0.0 -1,-0.1 -0.521 360.0 360.0 -71.2 360.0 24.8 -6.5 14.2