==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM BINDING 04-JUN-97 1JSA . COMPND 2 MOLECULE: RECOVERIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.B.AMES,R.ISHIMA,T.TANAKA,J.I.GORDON,L.STRYER,M.IKURA . 188 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11864.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 58.5 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 . 5 2.7 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 . 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 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 5 0 0 2 0 0 1 0 2 0 1 0 0 0 0 0 0 0 0 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 . 1 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 0 129 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 8.2 -35.7 24.6 31.7 2 2 A N - 0 0 125 0, 0.0 2,-0.4 0, 0.0 0, 0.0 -0.999 360.0-108.0-146.1 141.8 -32.2 26.2 31.7 3 3 A S - 0 0 125 -2,-0.3 2,-0.2 1,-0.0 0, 0.0 -0.536 38.0-155.4 -70.8 120.7 -29.1 25.8 29.6 4 4 A K + 0 0 168 -2,-0.4 -1,-0.0 1,-0.1 0, 0.0 -0.634 21.9 176.1 -96.3 156.2 -26.4 24.1 31.7 5 5 A S - 0 0 55 -2,-0.2 26,-0.2 24,-0.0 -1,-0.1 0.645 51.9-102.0-124.5 -42.4 -22.6 24.3 31.1 6 6 A G - 0 0 5 25,-0.1 -2,-0.0 24,-0.0 3,-0.0 0.582 64.4 -72.0 121.7 25.2 -21.0 22.3 33.9 7 7 A A S S+ 0 0 84 76,-0.0 2,-0.3 1,-0.0 76,-0.1 0.587 123.3 55.4 69.6 6.7 -19.8 25.1 36.3 8 8 A L + 0 0 9 20,-0.1 23,-0.1 19,-0.1 -1,-0.0 -0.898 53.1 96.6-169.9 137.7 -17.2 25.9 33.7 9 9 A S S > S+ 0 0 20 -2,-0.3 4,-1.6 -3,-0.0 5,-0.1 0.033 86.2 52.7 171.6 -41.0 -17.0 26.8 30.0 10 10 A K H > S+ 0 0 139 2,-0.2 4,-0.7 3,-0.1 -2,-0.0 0.762 108.8 51.8 -86.9 -26.6 -16.8 30.5 29.7 11 11 A E H 4 S+ 0 0 117 2,-0.2 -1,-0.1 1,-0.1 -3,-0.0 0.850 117.4 38.8 -77.1 -33.6 -13.9 30.8 32.1 12 12 A I H >4 S+ 0 0 1 2,-0.2 3,-4.1 1,-0.2 4,-0.2 0.949 110.1 54.9 -81.6 -53.7 -11.9 28.2 30.2 13 13 A L H >< S+ 0 0 55 -4,-1.6 3,-5.1 1,-0.3 4,-0.2 0.841 89.9 80.1 -49.8 -28.6 -12.8 29.1 26.7 14 14 A E G >< S+ 0 0 132 -4,-0.7 3,-0.5 1,-0.3 -1,-0.3 0.747 85.0 61.9 -50.3 -18.0 -11.5 32.5 27.7 15 15 A E G < + 0 0 61 -3,-4.1 3,-0.4 1,-0.2 -1,-0.3 0.551 65.8 115.1 -84.6 -8.2 -8.2 30.8 27.0 16 16 A L G < S+ 0 0 99 -3,-5.1 -1,-0.2 1,-0.2 -2,-0.1 0.761 70.8 63.7 -30.8 -35.0 -9.2 30.3 23.4 17 17 A Q S < S+ 0 0 150 -3,-0.5 2,-0.5 -4,-0.2 81,-0.3 0.994 98.0 50.6 -58.6 -70.2 -6.3 32.7 22.7 18 18 A L S S- 0 0 61 -3,-0.4 3,-0.1 79,-0.1 -1,-0.1 -0.581 125.0 -10.1 -73.9 118.7 -3.5 30.5 24.0 19 19 A N S S- 0 0 0 -2,-0.5 2,-0.9 79,-0.4 76,-0.1 0.532 83.0-100.8 67.9 137.6 -3.7 27.1 22.4 20 20 A T - 0 0 104 74,-0.5 -1,-0.1 2,-0.0 -4,-0.1 -0.794 37.6-126.8 -95.9 103.8 -6.8 26.0 20.4 21 21 A K - 0 0 17 -2,-0.9 3,-0.3 -3,-0.1 -2,-0.0 -0.116 23.4-113.4 -46.2 139.4 -9.0 23.8 22.6 22 22 A F S S- 0 0 139 1,-0.2 2,-0.2 2,-0.1 -1,-0.1 0.907 91.6 -26.9 -41.4 -51.8 -9.7 20.5 21.0 23 23 A T >> - 0 0 71 1,-0.1 3,-4.5 0, 0.0 4,-0.7 -0.783 50.2-132.4-169.8 120.8 -13.4 21.6 20.8 24 24 A E T 34 S+ 0 0 107 1,-0.3 -11,-0.1 -3,-0.3 -2,-0.1 0.773 114.1 58.5 -47.8 -23.4 -15.4 24.0 22.9 25 25 A E T 3> S+ 0 0 136 1,-0.1 4,-0.6 2,-0.1 -1,-0.3 0.345 96.1 68.0 -88.9 7.8 -17.9 21.1 22.9 26 26 A E H <> S+ 0 0 62 -3,-4.5 4,-1.5 2,-0.2 3,-0.4 0.930 94.2 46.6 -90.1 -61.4 -15.3 18.8 24.4 27 27 A L H < S+ 0 0 3 -4,-0.7 4,-0.2 1,-0.2 -1,-0.1 0.411 104.9 74.6 -63.8 10.0 -14.8 20.1 27.9 28 28 A S H >> S+ 0 0 42 2,-0.1 3,-0.9 3,-0.1 4,-0.7 0.945 104.6 25.3 -86.5 -61.4 -18.5 20.2 28.0 29 29 A S H 3X S+ 0 0 72 -4,-0.6 4,-1.9 -3,-0.4 -2,-0.2 0.678 113.4 71.7 -76.6 -15.3 -19.6 16.6 28.4 30 30 A W H 3X S+ 0 0 62 -4,-1.5 4,-0.7 1,-0.2 -1,-0.2 0.729 90.5 60.8 -71.6 -20.0 -16.2 15.9 29.9 31 31 A Y H <> S+ 0 0 41 -3,-0.9 4,-1.5 -4,-0.2 3,-0.3 0.944 108.1 39.7 -73.0 -47.6 -17.4 17.8 33.0 32 32 A Q H X S+ 0 0 111 -4,-0.7 4,-1.8 1,-0.2 5,-0.2 0.946 106.3 63.2 -67.8 -47.6 -20.3 15.5 33.8 33 33 A S H X S+ 0 0 74 -4,-1.9 4,-1.0 1,-0.3 -1,-0.2 0.835 107.3 47.5 -46.4 -31.8 -18.4 12.3 33.0 34 34 A F H X S+ 0 0 26 -4,-0.7 4,-0.7 -3,-0.3 3,-0.4 0.897 102.3 59.8 -77.8 -40.8 -16.2 13.2 35.8 35 35 A L H < S+ 0 0 53 -4,-1.5 3,-0.3 1,-0.3 -2,-0.2 0.790 102.6 57.7 -57.6 -23.7 -19.0 14.0 38.2 36 36 A K H < S+ 0 0 169 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.904 93.3 61.9 -74.6 -40.7 -20.0 10.4 37.6 37 37 A E H < S- 0 0 84 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.719 133.7 -8.1 -58.1 -14.4 -16.6 9.0 38.8 38 38 A C < - 0 0 46 -4,-0.7 2,-1.9 -3,-0.3 -1,-0.3 -0.607 63.4-130.3 177.4 116.4 -17.6 10.6 42.0 39 39 A P S S+ 0 0 129 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.141 84.6 98.9 -62.2 29.5 -20.6 13.0 42.9 40 40 A S S S- 0 0 74 -2,-1.9 -2,-0.1 -5,-0.1 3,-0.1 0.359 71.4-138.4 -90.6-134.6 -17.9 15.1 44.5 41 41 A G S S+ 0 0 34 1,-0.3 2,-0.4 -7,-0.0 41,-0.3 0.293 72.5 71.6-173.9 4.1 -16.3 18.2 43.0 42 42 A R - 0 0 132 39,-0.1 2,-0.5 40,-0.0 -1,-0.3 -0.988 65.8-139.6-138.1 128.7 -12.5 18.0 43.9 43 43 A I B -A 80 0A 12 37,-1.9 37,-2.2 -2,-0.4 5,-0.0 -0.723 21.4-139.5 -88.4 129.8 -9.9 15.7 42.5 44 44 A T - 0 0 68 -2,-0.5 4,-0.2 35,-0.2 35,-0.1 -0.245 14.0-123.4 -79.2 173.0 -7.4 14.4 45.0 45 45 A R S > S+ 0 0 101 33,-0.2 4,-0.6 2,-0.2 3,-0.4 0.834 108.6 54.8 -86.5 -34.5 -3.7 14.0 44.3 46 46 A Q T 4 S+ 0 0 126 1,-0.2 3,-0.3 2,-0.2 4,-0.2 0.828 111.7 45.3 -68.2 -29.7 -3.5 10.3 45.1 47 47 A E T >4 S+ 0 0 54 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.579 90.1 86.3 -88.9 -9.6 -6.2 9.6 42.6 48 48 A F T >> S+ 0 0 4 -3,-0.4 3,-1.1 1,-0.3 4,-0.9 0.890 89.4 50.2 -57.3 -38.1 -4.7 11.8 40.0 49 49 A Q H 3X S+ 0 0 41 -4,-0.6 4,-0.6 -3,-0.3 -1,-0.3 0.719 92.2 76.8 -73.6 -18.9 -2.5 8.9 38.8 50 50 A T H <4 S+ 0 0 78 -3,-0.9 -1,-0.2 -4,-0.2 -2,-0.2 0.666 96.4 50.1 -65.5 -12.2 -5.6 6.7 38.6 51 51 A I H X> S+ 0 0 39 -3,-1.1 3,-3.5 -4,-0.4 4,-0.5 0.911 94.4 64.2 -90.4 -52.1 -6.4 8.6 35.3 52 52 A Y H 3X S+ 0 0 11 -4,-0.9 4,-1.2 1,-0.3 -2,-0.2 0.668 88.0 78.4 -47.1 -13.1 -3.1 8.3 33.5 53 53 A S H 3< S+ 0 0 75 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.573 87.8 57.1 -75.1 -6.4 -3.9 4.6 33.5 54 54 A K H <4 S+ 0 0 149 -3,-3.5 -1,-0.2 2,-0.1 -2,-0.2 0.846 113.7 33.2 -91.3 -38.4 -6.3 5.2 30.7 55 55 A F H < S+ 0 0 100 -4,-0.5 -2,-0.2 1,-0.2 -3,-0.1 0.544 132.4 30.5 -94.5 -7.3 -3.9 6.8 28.2 56 56 A F < + 0 0 41 -4,-1.2 -1,-0.2 2,-0.1 -2,-0.1 -0.288 58.9 150.8-148.7 59.6 -0.9 4.8 29.2 57 57 A P S S+ 0 0 96 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.424 71.3 66.2 -70.6 3.2 -1.8 1.3 30.5 58 58 A E S S+ 0 0 177 -3,-0.1 -2,-0.1 73,-0.0 -5,-0.0 0.906 102.0 23.7 -88.9 -80.8 1.6 0.1 29.3 59 59 A A S S- 0 0 21 72,-0.2 72,-0.2 1,-0.1 73,-0.1 0.370 91.1 -98.9 -65.1-151.8 4.5 1.7 31.2 60 60 A D > + 0 0 89 70,-0.7 3,-1.3 72,-0.1 4,-0.2 -0.464 42.8 166.6-137.0 64.4 4.1 3.1 34.7 61 61 A P T 3> + 0 0 6 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.232 50.1 109.6 -64.2 19.8 3.7 6.8 34.4 62 62 A K H 3> S+ 0 0 119 1,-0.2 4,-0.7 2,-0.2 -13,-0.1 0.807 75.0 50.1 -68.4 -28.4 2.6 6.6 38.0 63 63 A A H <4 S+ 0 0 31 -3,-1.3 -1,-0.2 64,-0.2 4,-0.2 0.833 116.7 39.6 -79.1 -32.2 5.9 8.3 39.1 64 64 A Y H > S+ 0 0 6 63,-0.4 4,-1.0 -4,-0.2 3,-0.3 0.624 104.9 68.7 -90.4 -14.0 5.4 11.2 36.6 65 65 A A H < S+ 0 0 0 -4,-1.5 4,-0.2 1,-0.2 -1,-0.2 0.815 96.9 52.2 -74.3 -28.9 1.7 11.4 37.2 66 66 A Q T X S+ 0 0 69 -4,-0.7 4,-0.8 1,-0.2 -1,-0.2 0.635 104.3 58.7 -81.4 -12.1 2.2 12.7 40.7 67 67 A H H > S+ 0 0 41 -3,-0.3 4,-0.7 1,-0.2 -1,-0.2 0.803 94.0 62.5 -85.0 -30.5 4.5 15.4 39.4 68 68 A V H < S+ 0 0 5 -4,-1.0 4,-0.4 2,-0.1 -1,-0.2 0.609 99.3 62.9 -69.9 -9.3 1.9 17.0 37.1 69 69 A F H >> S+ 0 0 5 -4,-0.2 3,-2.9 -3,-0.2 4,-2.8 0.966 102.4 38.5 -78.8 -77.8 -0.1 17.7 40.2 70 70 A R H 3< S+ 0 0 130 -4,-0.8 4,-0.3 1,-0.3 -1,-0.2 0.713 101.3 85.6 -47.5 -14.0 1.9 20.1 42.3 71 71 A S T 3< S- 0 0 12 -4,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.895 121.8 -12.5 -56.1 -40.2 2.7 21.5 38.9 72 72 A F T X4 S+ 0 0 85 -3,-2.9 3,-0.6 -4,-0.4 -2,-0.2 0.350 120.1 84.3-142.8 1.9 -0.4 23.6 39.0 73 73 A D T 3<>S+ 0 0 4 -4,-2.8 5,-0.9 1,-0.2 4,-0.3 0.116 71.8 83.3 -95.3 23.6 -2.5 22.3 41.9 74 74 A A T 3 5 + 0 0 63 -4,-0.3 2,-3.7 -5,-0.2 -1,-0.2 0.267 48.4 120.5-106.0 9.2 -0.6 24.5 44.3 75 75 A N T < 5S- 0 0 79 -3,-0.6 -1,-0.1 1,-0.2 -2,-0.0 -0.229 104.7 -77.9 -70.1 57.2 -2.6 27.6 43.7 76 76 A S T 5S+ 0 0 126 -2,-3.7 -1,-0.2 1,-0.1 -2,-0.1 0.954 115.1 95.4 45.7 62.9 -3.6 27.7 47.3 77 77 A D T 5 - 0 0 39 -4,-0.3 -3,-0.1 0, 0.0 -1,-0.1 0.436 67.9-147.1-141.8 -64.1 -6.2 24.9 46.9 78 78 A G S - 0 0 54 -2,-0.6 4,-1.7 -39,-0.2 5,-0.1 -0.523 26.6-113.4 -89.7 160.3 -10.5 21.5 39.8 82 82 A F H > S+ 0 0 11 -41,-0.3 4,-2.2 2,-0.2 5,-0.2 0.871 113.9 58.9 -60.4 -36.0 -12.0 20.6 36.4 83 83 A K H > S+ 0 0 80 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.984 112.9 35.3 -57.7 -60.2 -11.2 24.1 35.1 84 84 A E H > S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.744 112.2 66.1 -67.1 -20.6 -7.5 23.9 35.8 85 85 A Y H X S+ 0 0 13 -4,-1.7 4,-3.2 1,-0.2 5,-0.3 0.963 97.6 49.7 -66.4 -51.0 -7.6 20.2 34.9 86 86 A V H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.883 107.1 58.8 -55.9 -36.6 -8.5 20.7 31.2 87 87 A I H X S+ 0 0 17 -4,-1.1 4,-1.5 -5,-0.2 -1,-0.2 0.970 113.9 34.2 -57.9 -54.6 -5.6 23.2 31.0 88 88 A A H X S+ 0 0 11 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.938 117.7 53.0 -67.9 -46.1 -3.0 20.7 32.0 89 89 A L H < S+ 0 0 32 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.882 117.1 38.5 -58.0 -38.4 -4.6 17.7 30.3 90 90 A H H >< S+ 0 0 15 -4,-2.6 3,-1.2 -5,-0.3 -1,-0.2 0.716 106.4 67.6 -85.5 -19.8 -4.8 19.6 27.0 91 91 A M H 3< S+ 0 0 25 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.905 86.3 67.1 -66.1 -39.7 -1.4 21.2 27.6 92 92 A T T 3< S- 0 0 27 -4,-1.7 -1,-0.3 -5,-0.1 2,-0.1 0.405 129.1 -11.7 -62.8 10.0 0.4 17.9 27.2 93 93 A S S < S+ 0 0 65 -3,-1.2 -3,-0.1 2,-0.1 -4,-0.0 -0.445 70.2 128.3-166.0-116.4 -0.8 18.1 23.6 94 94 A A S S- 0 0 19 -2,-0.1 -74,-0.5 2,-0.1 -3,-0.1 0.695 88.5 -98.4 48.5 14.9 -3.3 20.4 21.7 95 95 A G - 0 0 47 1,-0.1 2,-0.6 -76,-0.1 -2,-0.1 -0.099 51.4 -65.0 67.9-173.9 -0.3 20.8 19.4 96 96 A K + 0 0 146 -77,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.920 63.1 154.0-117.8 108.5 2.0 23.9 19.5 97 97 A T - 0 0 43 -2,-0.6 2,-0.3 1,-0.2 -79,-0.1 0.395 53.0 -35.4-100.1-124.5 0.4 27.2 18.7 98 98 A N S S- 0 0 123 -81,-0.3 -79,-0.4 3,-0.0 -1,-0.2 -0.778 104.2 -23.0-105.8 150.0 1.5 30.7 19.9 99 99 A Q S S+ 0 0 144 -2,-0.3 -2,-0.0 -81,-0.1 -81,-0.0 -0.330 95.7 100.4 55.9-123.9 3.0 31.5 23.3 100 100 A K + 0 0 20 1,-0.2 -1,-0.1 -2,-0.1 -4,-0.0 0.095 34.7 102.0 40.0-157.6 1.9 28.9 25.8 101 101 A L > + 0 0 51 1,-0.1 3,-1.1 -3,-0.1 4,-0.5 0.362 56.9 105.3 69.7 -11.7 4.5 26.2 26.6 102 102 A E T > + 0 0 106 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.785 62.1 71.8 -70.9 -25.1 5.0 28.1 29.8 103 103 A W T >> S+ 0 0 26 1,-0.2 4,-1.0 2,-0.2 3,-0.6 0.693 85.8 70.4 -63.9 -14.7 3.1 25.4 31.7 104 104 A A H X> S+ 0 0 15 -3,-1.1 4,-1.9 1,-0.2 3,-0.8 0.953 89.8 55.3 -68.5 -48.8 6.2 23.2 31.1 105 105 A F H <4 S+ 0 0 16 -3,-0.5 4,-0.5 -4,-0.5 -1,-0.2 0.592 104.3 61.5 -61.3 -4.8 8.5 25.1 33.5 106 106 A S H <4 S+ 0 0 29 -3,-0.6 -1,-0.2 -4,-0.3 -2,-0.2 0.853 104.1 42.4 -89.4 -38.6 5.8 24.5 36.0 107 107 A L H << S+ 0 0 4 -4,-1.0 3,-0.3 -3,-0.8 -2,-0.2 0.849 116.3 49.0 -76.6 -32.6 5.9 20.7 36.0 108 108 A Y S < S+ 0 0 8 -4,-1.9 2,-1.3 1,-0.2 3,-0.2 0.796 101.0 66.9 -76.5 -26.2 9.7 20.6 35.9 109 109 A D + 0 0 9 -4,-0.5 -1,-0.2 -5,-0.3 5,-0.1 -0.399 64.8 166.0 -91.5 59.9 9.9 23.0 38.8 110 110 A V S S+ 0 0 44 -2,-1.3 -1,-0.2 -3,-0.3 -2,-0.1 0.908 78.1 36.4 -38.0 -69.1 8.4 20.6 41.3 111 111 A D S S- 0 0 79 -3,-0.2 -1,-0.2 2,-0.0 -2,-0.1 0.927 107.2-134.1 -54.7 -45.3 9.4 22.7 44.4 112 112 A G + 0 0 49 3,-0.1 -2,-0.1 -4,-0.1 4,-0.1 0.925 46.4 154.5 87.9 75.9 8.7 25.9 42.5 113 113 A N - 0 0 90 2,-0.3 -1,-0.1 0, 0.0 -3,-0.1 -0.078 66.0-106.6-123.8 32.7 11.6 28.3 43.1 114 114 A G S S+ 0 0 38 -5,-0.1 54,-0.7 -9,-0.1 2,-0.3 0.477 105.4 64.2 58.4 -4.7 11.4 30.4 40.0 115 115 A T E S-B 167 0B 44 52,-0.2 -2,-0.3 53,-0.1 52,-0.2 -0.992 78.9-132.4-150.1 139.5 14.5 28.5 38.9 116 116 A I E -B 166 0B 2 50,-3.3 50,-1.2 -2,-0.3 2,-0.2 -0.616 23.9-173.1 -92.1 152.9 15.2 24.9 38.2 117 117 A S > - 0 0 39 -2,-0.2 4,-2.0 48,-0.2 5,-0.2 -0.780 42.3 -91.4-133.7 178.4 18.2 22.9 39.7 118 118 A K H > S+ 0 0 128 -2,-0.2 4,-1.8 46,-0.2 5,-0.1 0.892 119.1 57.8 -61.1 -39.5 19.8 19.5 39.3 119 119 A N H >> S+ 0 0 104 2,-0.2 4,-1.8 1,-0.2 3,-1.5 0.987 109.6 39.5 -55.0 -70.3 17.7 18.1 42.1 120 120 A E H 3> S+ 0 0 9 1,-0.3 4,-1.8 2,-0.2 5,-0.4 0.911 114.0 56.2 -46.5 -47.9 14.3 18.7 40.7 121 121 A V H 3X S+ 0 0 11 -4,-2.0 4,-1.2 1,-0.2 -1,-0.3 0.846 105.2 54.2 -55.6 -32.1 15.6 17.8 37.2 122 122 A L H X S+ 0 0 4 -4,-2.9 4,-1.5 -5,-0.3 3,-0.7 0.954 106.2 52.6 -56.8 -49.9 10.1 9.5 36.9 128 128 A I H 3X S+ 0 0 9 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.2 0.855 102.8 61.1 -55.3 -33.2 10.1 10.0 33.1 129 129 A F H 3< S+ 0 0 31 -4,-1.5 3,-0.3 1,-0.2 -1,-0.3 0.909 98.5 55.6 -61.8 -40.8 12.3 6.9 32.9 130 130 A K H << S+ 0 0 129 -4,-1.5 -70,-0.7 -3,-0.7 -1,-0.2 0.937 103.3 54.6 -57.7 -45.2 9.6 4.8 34.5 131 131 A M H < S+ 0 0 30 -4,-1.5 -1,-0.3 -72,-0.2 -2,-0.2 0.863 95.8 83.7 -57.1 -34.6 7.2 5.9 31.8 132 132 A I S < S- 0 0 43 -4,-1.4 -72,-0.1 -3,-0.3 3,-0.0 -0.458 83.3-128.1 -70.6 142.5 9.8 4.7 29.2 133 133 A S >> - 0 0 33 -2,-0.1 4,-1.9 1,-0.1 3,-1.1 -0.683 11.1-125.1 -93.3 147.2 9.6 1.0 28.5 134 134 A P H 3> S+ 0 0 107 0, 0.0 4,-0.7 0, 0.0 3,-0.2 0.907 112.3 58.6 -53.8 -45.2 12.7 -1.3 28.7 135 135 A E H 34 S+ 0 0 158 1,-0.3 3,-0.2 2,-0.2 -3,-0.0 0.835 116.1 35.6 -55.5 -31.0 12.1 -2.5 25.2 136 136 A D H X> S+ 0 0 84 -3,-1.1 3,-1.7 1,-0.2 4,-0.9 0.622 99.9 77.9 -96.8 -15.9 12.4 1.2 24.1 137 137 A T H 3< S+ 0 0 19 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.621 86.4 64.3 -68.5 -9.7 15.1 2.1 26.7 138 138 A K T 3< S+ 0 0 137 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.1 0.591 93.0 62.4 -88.4 -10.2 17.6 0.4 24.4 139 139 A H T <4 S+ 0 0 150 -3,-1.7 -2,-0.2 2,-0.1 -1,-0.1 0.915 85.5 81.7 -80.4 -44.9 16.9 3.0 21.7 140 140 A L S < S- 0 0 26 -4,-0.9 4,-0.1 1,-0.1 5,-0.0 -0.244 102.9 -81.3 -59.9 150.0 18.1 6.0 23.6 141 141 A P > - 0 0 71 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.252 31.9-132.4 -54.2 132.4 21.9 6.6 23.6 142 142 A E G > S+ 0 0 122 1,-0.3 3,-1.5 -4,-0.1 4,-0.2 0.753 97.1 87.6 -59.7 -21.5 23.6 4.4 26.2 143 143 A D G 3 S+ 0 0 116 1,-0.3 -1,-0.3 2,-0.1 10,-0.1 0.469 103.9 28.2 -59.0 5.7 25.5 7.5 27.3 144 144 A E G < + 0 0 3 -3,-1.3 -1,-0.3 -4,-0.1 6,-0.1 -0.147 69.4 139.2-161.4 52.6 22.4 8.0 29.5 145 145 A N S < S+ 0 0 68 -3,-1.5 -2,-0.1 4,-0.1 -3,-0.1 0.483 72.6 48.8 -80.3 -0.7 20.9 4.7 30.4 146 146 A T S >> S- 0 0 61 -4,-0.2 4,-2.0 1,-0.1 3,-0.7 -0.975 86.5-116.2-139.3 154.0 20.3 5.9 33.9 147 147 A P H 3> S+ 0 0 28 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.833 119.6 48.4 -54.9 -34.5 18.8 9.0 35.6 148 148 A E H 34 S+ 0 0 134 1,-0.2 4,-0.2 2,-0.2 -3,-0.0 0.765 113.0 47.3 -79.1 -24.5 22.2 9.8 37.0 149 149 A K H <4 S+ 0 0 82 -3,-0.7 4,-0.2 1,-0.1 -1,-0.2 0.675 113.1 48.4 -89.2 -17.8 23.9 9.3 33.7 150 150 A R H >X S+ 0 0 17 -4,-2.0 3,-2.5 2,-0.2 4,-1.9 0.802 88.3 78.4 -90.6 -32.8 21.4 11.4 31.8 151 151 A A H 3X S+ 0 0 18 -4,-1.5 4,-1.3 1,-0.3 5,-0.2 0.794 95.7 54.7 -46.1 -24.3 21.3 14.4 34.1 152 152 A E H 3> S+ 0 0 112 -4,-0.2 4,-0.6 3,-0.2 -1,-0.3 0.788 105.4 50.9 -81.0 -27.6 24.6 15.2 32.3 153 153 A K H <> S+ 0 0 64 -3,-2.5 4,-1.6 -4,-0.2 -2,-0.2 0.958 118.2 35.3 -74.4 -50.3 22.9 15.0 28.9 154 154 A I H >X S+ 0 0 8 -4,-1.9 4,-1.7 2,-0.2 3,-0.9 0.991 122.7 42.9 -66.7 -60.9 20.1 17.4 29.7 155 155 A W H 3X>S+ 0 0 45 -4,-1.3 4,-1.8 -5,-0.3 5,-0.5 0.823 114.7 55.1 -55.2 -28.2 21.9 19.7 32.0 156 156 A G H 3<5S+ 0 0 52 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.830 101.0 57.8 -75.1 -31.1 24.7 19.5 29.5 157 157 A F H <<5S+ 0 0 93 -4,-1.6 -2,-0.2 -3,-0.9 -1,-0.2 0.947 111.9 40.1 -64.8 -46.7 22.5 20.6 26.6 158 158 A F H <5S- 0 0 44 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.1 0.996 97.2-144.1 -65.5 -62.8 21.5 23.9 28.3 159 159 A G T <5 - 0 0 54 -4,-1.8 2,-0.4 -5,-0.2 -3,-0.1 0.874 20.2-173.2 95.2 77.2 25.0 24.7 29.7 160 160 A K < + 0 0 54 -5,-0.5 4,-0.2 1,-0.1 -1,-0.1 -0.823 21.8 139.1-105.4 142.7 24.7 26.4 33.1 161 161 A K S > S+ 0 0 163 -2,-0.4 3,-0.8 2,-0.1 -1,-0.1 0.257 71.2 24.0-140.0 -89.0 27.6 28.0 35.0 162 162 A D T 3 S+ 0 0 135 1,-0.3 2,-1.3 2,-0.1 -2,-0.1 0.973 134.2 34.4 -52.1 -61.3 27.4 31.3 36.9 163 163 A D T 3 S- 0 0 100 1,-0.1 2,-3.4 2,-0.0 -1,-0.3 -0.580 75.8-176.0 -96.1 72.4 23.7 31.1 37.4 164 164 A D < + 0 0 82 -2,-1.3 2,-0.4 -3,-0.8 -46,-0.2 0.076 58.6 90.4 -58.6 33.6 23.4 27.3 37.8 165 165 A K S S- 0 0 78 -2,-3.4 2,-0.4 -48,-0.1 -48,-0.2 -0.927 72.9-140.0-136.5 111.4 19.6 27.8 38.0 166 166 A L E -B 116 0B 7 -50,-1.2 -50,-3.3 -2,-0.4 2,-0.2 -0.542 20.4-147.9 -73.2 127.3 17.5 27.7 34.8 167 167 A T E > -B 115 0B 37 -2,-0.4 4,-2.4 -52,-0.2 3,-0.3 -0.516 24.3-112.9 -91.5 161.1 14.8 30.3 34.9 168 168 A E T 4 S+ 0 0 63 -54,-0.7 4,-0.5 1,-0.2 -63,-0.1 0.728 112.3 67.4 -65.3 -19.1 11.3 30.0 33.3 169 169 A K T > S+ 0 0 135 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.959 112.7 26.8 -66.8 -50.1 12.3 32.7 30.8 170 170 A E H >>S+ 0 0 109 -3,-0.3 4,-2.9 1,-0.2 5,-0.6 0.819 102.4 81.3 -82.3 -31.3 15.0 30.6 29.0 171 171 A F H <5S+ 0 0 12 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.762 99.4 46.4 -45.4 -21.4 13.4 27.3 29.8 172 172 A I H >5S+ 0 0 41 -3,-0.5 4,-1.0 -4,-0.5 -1,-0.3 0.839 119.7 35.6 -90.4 -38.2 11.3 28.3 26.9 173 173 A E H >X5S+ 0 0 108 -4,-0.6 4,-1.9 -3,-0.5 3,-0.5 0.939 105.5 65.1 -81.1 -49.8 14.1 29.4 24.6 174 174 A G H 3<5S+ 0 0 24 -4,-2.9 4,-0.4 1,-0.3 -1,-0.2 0.752 112.4 42.0 -44.6 -20.3 16.7 26.8 25.6 175 175 A T H 34 - 0 0 106 -4,-0.4 3,-3.9 1,-0.2 4,-0.4 -0.709 68.5-152.0 -85.8 104.3 17.3 22.6 18.7 179 179 A K T 3 S+ 0 0 164 -2,-1.0 4,-0.3 1,-0.3 -1,-0.2 0.687 95.5 71.9 -48.1 -13.2 13.8 21.2 18.1 180 180 A E T 3 S+ 0 0 114 1,-0.1 4,-0.3 2,-0.1 -1,-0.3 0.449 85.3 69.2 -83.5 1.9 15.6 18.0 18.9 181 181 A I S X> S+ 0 0 12 -3,-3.9 3,-3.5 -6,-0.3 4,-0.8 0.964 88.2 54.6 -82.4 -62.8 15.8 19.0 22.5 182 182 A L T 34 S+ 0 0 82 -7,-0.4 -1,-0.2 -4,-0.4 -2,-0.1 0.724 98.6 72.3 -44.7 -18.2 12.2 18.9 23.7 183 183 A R T 34 S+ 0 0 147 -4,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.842 100.1 42.1 -68.8 -32.7 12.5 15.3 22.4 184 184 A L T <4 S+ 0 0 38 -3,-3.5 -2,-0.2 -4,-0.3 -1,-0.1 0.980 122.7 33.5 -76.9 -69.2 14.7 14.3 25.3 185 185 A I S < S+ 0 0 11 -4,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.393 95.8 147.0 -68.3 9.3 13.0 16.0 28.3 186 186 A Q - 0 0 62 -5,-0.4 2,-0.4 1,-0.1 -3,-0.1 0.066 41.3-147.6 -42.2 157.2 9.9 15.3 26.3 187 187 A F 0 0 58 -5,-0.1 -1,-0.1 -95,-0.1 -2,-0.1 -0.784 360.0 360.0-137.4 92.2 6.8 14.6 28.4 188 188 A E 0 0 99 -2,-0.4 -2,-0.1 -60,-0.1 -95,-0.1 -0.430 360.0 360.0 73.8 360.0 4.3 12.2 26.8