==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLASMA PROTEIN 05-MAR-03 1HK1 . COMPND 2 MOLECULE: SERUM ALBUMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.PETITPAS,C.E.PETERSEN,C.E.HA,A.A.BHATTACHARYA, . 553 2 17 16 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27013.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 422 76.3 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 . 0 0.0 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 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 333 60.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 2 2 0 2 1 2 2 0 0 0 2 0 0 1 4 1 2 0 0 0 0 2 0 0 0 0 2 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A S > 0 0 65 0, 0.0 4,-0.6 0, 0.0 58,-0.2 0.000 360.0 360.0 360.0 144.2 -0.7 -19.4 -10.0 2 6 A E H > + 0 0 69 56,-0.7 4,-1.9 58,-0.5 5,-0.2 0.802 360.0 60.9-100.2 -39.1 -0.5 -17.3 -6.9 3 7 A V H > S+ 0 0 1 55,-0.3 4,-2.3 57,-0.2 5,-0.1 0.890 108.5 46.5 -55.1 -42.5 2.3 -14.9 -7.7 4 8 A A H > S+ 0 0 8 54,-0.2 4,-3.0 2,-0.2 5,-0.2 0.946 105.4 56.8 -66.0 -53.0 0.3 -13.6 -10.7 5 9 A H H X S+ 0 0 81 -4,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.893 114.6 41.8 -44.4 -45.8 -3.0 -13.2 -8.9 6 10 A R H X S+ 0 0 29 -4,-1.9 4,-2.8 2,-0.2 5,-0.4 0.924 110.2 53.6 -70.7 -49.4 -1.1 -10.9 -6.4 7 11 A F H X S+ 0 0 25 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.914 110.1 51.6 -53.4 -43.1 1.0 -9.0 -8.9 8 12 A K H < S+ 0 0 136 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.898 113.7 40.9 -61.6 -45.6 -2.2 -8.2 -10.8 9 13 A D H < S+ 0 0 84 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.899 121.7 38.6 -73.0 -42.6 -4.1 -6.8 -7.8 10 14 A L H X S- 0 0 16 -4,-2.8 4,-0.6 -5,-0.1 5,-0.2 0.662 104.2-132.0 -84.2 -16.7 -1.3 -4.9 -6.1 11 15 A G H X - 0 0 31 -4,-1.8 4,-2.4 -5,-0.4 5,-0.2 0.191 30.9 -79.7 78.0 152.6 0.3 -3.6 -9.3 12 16 A E H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.922 124.7 55.6 -54.8 -51.6 4.0 -3.8 -9.9 13 17 A E H > S+ 0 0 142 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.935 114.8 36.6 -49.8 -58.7 5.0 -0.8 -7.8 14 18 A N H X S+ 0 0 41 -4,-0.6 4,-3.7 1,-0.2 5,-0.3 0.920 113.8 58.4 -61.2 -44.7 3.5 -2.0 -4.6 15 19 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.880 108.6 45.5 -53.2 -41.2 4.4 -5.6 -5.3 16 20 A K H X S+ 0 0 42 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.913 114.6 48.5 -69.6 -41.0 8.0 -4.7 -5.5 17 21 A A H X S+ 0 0 15 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.945 112.5 47.7 -62.6 -50.0 7.8 -2.6 -2.4 18 22 A L H X S+ 0 0 0 -4,-3.7 4,-2.9 2,-0.2 -1,-0.2 0.891 111.9 48.9 -60.5 -42.5 6.0 -5.3 -0.4 19 23 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.928 111.3 50.7 -65.5 -42.1 8.4 -8.0 -1.5 20 24 A L H X S+ 0 0 6 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.907 111.8 47.2 -60.7 -42.0 11.3 -5.8 -0.5 21 25 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.957 108.5 56.4 -62.9 -48.7 9.8 -5.1 2.9 22 26 A A H X S+ 0 0 5 -4,-2.9 4,-1.3 1,-0.2 -2,-0.2 0.874 110.8 42.6 -50.3 -46.3 9.1 -8.9 3.4 23 27 A F H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 3,-0.3 0.920 110.2 55.1 -70.4 -43.4 12.8 -9.8 2.9 24 28 A A H < S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.811 110.5 48.1 -59.9 -28.3 14.1 -6.9 5.0 25 29 A Q H < S+ 0 0 2 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.788 113.4 46.2 -82.4 -27.9 11.9 -8.2 7.8 26 30 A Y H < S+ 0 0 15 -4,-1.3 2,-0.3 -3,-0.3 -2,-0.2 0.790 124.9 30.9 -83.1 -28.4 13.0 -11.8 7.4 27 31 A L < + 0 0 42 -4,-2.7 3,-0.4 -5,-0.1 -1,-0.3 -0.753 64.2 169.5-132.2 85.4 16.8 -10.9 7.2 28 32 A Q S S+ 0 0 12 -2,-0.3 -1,-0.1 -3,-0.3 -4,-0.1 0.596 77.7 50.3 -73.6 -9.9 17.5 -7.8 9.2 29 33 A Q S S+ 0 0 108 2,-0.1 -1,-0.2 68,-0.0 -5,-0.1 0.701 83.5 101.8-101.9 -21.9 21.3 -8.2 8.9 30 34 A C S S- 0 0 49 -3,-0.4 -3,-0.1 1,-0.1 5,-0.1 -0.340 79.0 -98.9 -67.0 142.8 21.7 -8.7 5.1 31 35 A P > - 0 0 60 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 -0.045 26.2-115.6 -56.5 159.2 22.9 -5.7 3.0 32 36 A F H >> S+ 0 0 11 2,-0.2 4,-1.8 1,-0.2 3,-1.0 0.976 112.2 52.3 -60.6 -58.4 20.6 -3.5 1.0 33 37 A E H 3> S+ 0 0 118 1,-0.3 4,-2.2 2,-0.2 3,-0.2 0.904 104.2 55.9 -44.1 -56.9 22.0 -4.5 -2.4 34 38 A D H 3> S+ 0 0 91 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.825 107.6 50.4 -48.4 -38.9 21.6 -8.2 -1.8 35 39 A H H X S+ 0 0 96 -4,-2.6 4,-1.6 -5,-0.3 3,-0.8 0.967 108.9 57.2 -69.1 -50.5 10.7 -10.7 -13.1 45 49 A F H 3X S+ 0 0 64 -4,-2.5 4,-1.5 1,-0.3 -1,-0.2 0.806 106.7 51.6 -47.3 -36.0 9.7 -14.4 -12.4 46 50 A A H 3X S+ 0 0 0 -4,-1.5 4,-1.1 2,-0.2 -1,-0.3 0.858 101.4 58.8 -73.2 -37.1 6.2 -13.1 -11.6 47 51 A K H X S+ 0 0 65 -4,-1.6 4,-4.3 1,-0.2 3,-0.7 0.945 108.6 50.9 -66.8 -46.6 6.4 -14.4 -16.7 49 53 A a H 3< S+ 0 0 1 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.688 105.1 58.0 -63.9 -18.3 3.7 -16.1 -14.6 50 54 A V H 3< S+ 0 0 52 -4,-1.1 -1,-0.3 1,-0.1 3,-0.3 0.819 116.9 33.5 -79.3 -31.1 1.5 -13.1 -15.5 51 55 A A H << S+ 0 0 92 -4,-1.2 2,-0.7 -3,-0.7 -2,-0.2 0.896 129.3 35.7 -87.0 -49.0 2.0 -14.0 -19.2 52 56 A D >< - 0 0 38 -4,-4.3 3,-2.4 1,-0.1 -1,-0.3 -0.833 63.2-176.8-110.3 91.8 2.2 -17.8 -18.8 53 57 A E T 3 S+ 0 0 76 -2,-0.7 -1,-0.1 1,-0.3 -4,-0.1 0.602 92.3 45.4 -62.1 -8.9 -0.2 -18.8 -16.0 54 58 A S T 3 S+ 0 0 113 -3,-0.1 -1,-0.3 -53,-0.0 3,-0.1 0.212 86.4 128.5-118.0 10.9 1.2 -22.3 -16.6 55 59 A A S X S- 0 0 32 -3,-2.4 3,-1.0 1,-0.2 4,-0.2 0.086 73.1 -60.3 -57.8 178.9 4.9 -21.3 -16.8 56 60 A E T 3 S- 0 0 74 1,-0.2 -1,-0.2 2,-0.1 -7,-0.1 -0.394 116.6 -5.1 -68.3 139.1 7.5 -23.2 -14.7 57 61 A N T > S+ 0 0 92 1,-0.2 3,-1.4 -3,-0.1 -1,-0.2 0.495 91.3 121.2 57.8 7.0 7.2 -23.1 -11.0 58 62 A a T < + 0 0 1 -3,-1.0 -56,-0.7 1,-0.3 -55,-0.3 0.561 65.4 68.8 -74.4 -5.5 4.2 -20.7 -11.1 59 63 A D T 3 S+ 0 0 98 -4,-0.2 -1,-0.3 -58,-0.2 -3,-0.1 0.565 82.8 106.2 -86.0 -10.8 2.2 -23.3 -9.3 60 64 A K S < S- 0 0 80 -3,-1.4 -58,-0.5 1,-0.1 2,-0.3 0.159 74.3-108.8 -59.0 179.7 4.4 -22.7 -6.2 61 65 A S > - 0 0 50 1,-0.1 4,-2.3 -59,-0.1 3,-0.4 -0.858 24.9-116.9-112.5 148.8 3.3 -20.9 -3.0 62 66 A L H > S+ 0 0 12 -2,-0.3 4,-2.7 1,-0.2 5,-0.4 0.890 115.4 56.7 -53.4 -39.1 4.7 -17.4 -2.1 63 67 A H H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.911 107.7 45.1 -60.2 -44.1 6.3 -19.0 1.0 64 68 A T H > S+ 0 0 28 -3,-0.4 4,-3.5 2,-0.2 -1,-0.2 0.929 116.8 45.5 -66.4 -45.4 8.3 -21.5 -1.0 65 69 A L H X S+ 0 0 23 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.993 118.6 40.5 -59.9 -63.5 9.4 -19.0 -3.6 66 70 A F H X S+ 0 0 16 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.876 117.1 54.3 -51.7 -39.1 10.3 -16.3 -1.0 67 71 A G H X S+ 0 0 5 -4,-2.3 4,-1.0 -5,-0.4 -2,-0.2 0.963 107.8 45.8 -60.7 -55.0 11.8 -19.1 1.0 68 72 A D H >< S+ 0 0 74 -4,-3.5 3,-1.1 1,-0.2 4,-0.3 0.938 113.1 49.7 -54.2 -54.1 14.1 -20.5 -1.7 69 73 A K H >< S+ 0 0 64 -4,-2.4 3,-2.5 1,-0.3 -1,-0.2 0.935 108.7 51.6 -51.3 -54.1 15.4 -17.1 -2.7 70 74 A L H 3< S+ 0 0 17 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.715 104.6 60.8 -57.8 -20.3 16.2 -16.1 0.9 71 75 A b T << 0 0 44 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.498 360.0 360.0 -87.1 -3.6 18.0 -19.4 1.2 72 76 A T < 0 0 135 -3,-2.5 -2,-0.2 -4,-0.3 -1,-0.1 0.869 360.0 360.0 -92.9 360.0 20.5 -18.5 -1.6 73 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 74 89 A D 0 0 135 0, 0.0 12,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.5 19.5 -24.3 10.1 75 90 A c > + 0 0 11 1,-0.1 3,-1.0 2,-0.1 11,-0.1 0.928 360.0 42.4 -76.6 -48.6 16.3 -22.5 8.9 76 91 A b T 3 S+ 0 0 53 1,-0.3 -1,-0.1 -6,-0.1 7,-0.1 0.847 97.9 72.5 -67.6 -37.1 16.8 -23.4 5.2 77 92 A A T 3 S+ 0 0 96 2,-0.0 -1,-0.3 6,-0.0 2,-0.2 0.435 98.1 66.9 -60.5 5.5 17.9 -27.0 5.9 78 93 A K S < S- 0 0 102 -3,-1.0 2,-0.3 5,-0.1 -3,-0.0 -0.580 80.7-123.0-116.8-179.1 14.2 -27.5 6.7 79 94 A Q >> - 0 0 156 -2,-0.2 4,-1.8 1,-0.0 3,-0.8 -0.886 41.6 -36.9-132.4 163.5 11.1 -27.4 4.7 80 95 A E T 34 S+ 0 0 52 1,-0.3 -1,-0.0 -2,-0.3 -16,-0.0 -0.274 118.6 9.4 -55.8 133.5 7.7 -25.7 4.4 81 96 A P T >> S+ 0 0 76 0, 0.0 4,-2.2 0, 0.0 3,-1.0 -0.998 130.6 49.1 -92.2 -10.5 6.0 -24.9 6.7 82 97 A E H <> S+ 0 0 121 -3,-0.8 4,-0.6 1,-0.3 -2,-0.2 0.879 110.7 57.5 -50.8 -40.1 8.6 -25.6 9.5 83 98 A R H 3X S+ 0 0 17 -4,-1.8 4,-1.0 2,-0.2 -1,-0.3 0.796 107.1 45.1 -62.2 -35.1 11.1 -23.5 7.4 84 99 A N H X> S+ 0 0 5 -3,-1.0 4,-2.2 2,-0.2 3,-0.6 0.942 107.6 56.3 -75.2 -49.5 8.9 -20.4 7.3 85 100 A E H 3X S+ 0 0 96 -4,-2.2 4,-1.3 1,-0.3 -1,-0.2 0.679 101.9 63.5 -54.5 -16.6 8.0 -20.6 11.0 86 101 A c H 3X S+ 0 0 11 -4,-0.6 4,-0.8 -5,-0.3 -1,-0.3 0.957 104.5 40.8 -73.0 -53.7 11.8 -20.5 11.4 87 102 A F H << S+ 0 0 15 -4,-1.0 3,-0.5 -3,-0.6 4,-0.3 0.872 115.7 52.0 -62.1 -39.4 12.3 -17.0 9.9 88 103 A L H >< S+ 0 0 19 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.881 110.8 48.6 -63.2 -38.6 9.2 -15.8 11.8 89 104 A Q H 3< S+ 0 0 99 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.618 108.1 55.8 -77.8 -13.3 10.7 -17.2 14.9 90 105 A H T 3< S+ 0 0 104 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.335 73.9 127.2-101.7 6.1 14.0 -15.5 14.2 91 106 A K < - 0 0 17 -3,-0.9 2,-0.5 -4,-0.3 -65,-0.1 -0.448 52.1-142.1 -65.4 132.2 12.7 -11.9 13.8 92 107 A D - 0 0 74 -67,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.857 18.2-168.7-104.5 126.9 14.6 -9.5 16.1 93 108 A D S S+ 0 0 46 -2,-0.5 -1,-0.1 1,-0.2 355,-0.1 0.461 92.8 29.9 -88.2 -2.0 12.8 -6.7 17.9 94 109 A N S S- 0 0 110 354,-0.1 -1,-0.2 37,-0.0 36,-0.1 -0.284 81.6-175.1-153.8 60.1 16.1 -5.1 18.9 95 110 A P - 0 0 23 0, 0.0 -4,-0.0 0, 0.0 -66,-0.0 -0.083 38.6-114.8 -55.4 158.0 18.8 -5.9 16.2 96 111 A N + 0 0 111 2,-0.0 -67,-0.0 0, 0.0 0, 0.0 -0.018 67.0 148.9 -85.9 31.5 22.4 -4.8 16.8 97 112 A L - 0 0 37 1,-0.1 3,-0.1 32,-0.1 -68,-0.0 -0.418 52.5 -94.0 -73.3 141.0 21.9 -2.5 13.8 98 113 A P - 0 0 95 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.020 49.7 -87.2 -49.9 146.6 23.8 0.9 13.5 99 114 A R - 0 0 96 1,-0.1 2,-1.7 0, 0.0 0, 0.0 -0.399 41.7-126.2 -60.5 127.7 22.2 4.1 14.6 100 115 A L + 0 0 95 -3,-0.1 2,-0.2 -2,-0.1 -1,-0.1 -0.566 42.6 170.2 -81.7 81.7 20.1 5.4 11.7 101 116 A V - 0 0 123 -2,-1.7 0, 0.0 1,-0.0 0, 0.0 -0.610 28.5-131.8 -93.1 153.9 21.5 9.0 11.4 102 117 A R - 0 0 66 -2,-0.2 3,-0.1 1,-0.1 -2,-0.0 -0.926 18.6-137.3-110.5 123.4 20.7 11.3 8.5 103 118 A P - 0 0 77 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.142 53.4 -43.1 -62.3-174.2 23.6 13.2 6.7 104 119 A E >> - 0 0 143 1,-0.1 4,-2.0 3,-0.1 3,-0.9 -0.231 58.2-115.9 -57.6 140.6 23.4 16.9 5.7 105 120 A V H 3> S+ 0 0 14 1,-0.3 4,-2.9 2,-0.2 3,-0.2 0.898 116.9 45.1 -39.9 -63.3 20.2 18.0 4.1 106 121 A D H 3> S+ 0 0 93 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.802 108.4 61.6 -56.6 -28.6 21.7 18.8 0.7 107 122 A V H <> S+ 0 0 80 -3,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.966 110.0 37.6 -62.4 -53.0 23.6 15.5 1.0 108 123 A M H >X S+ 0 0 28 -4,-2.0 4,-2.1 -3,-0.2 3,-0.5 0.962 114.6 56.8 -61.2 -52.0 20.3 13.5 1.1 109 124 A d H 3X S+ 0 0 2 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.842 102.6 54.6 -46.8 -44.0 18.7 15.9 -1.4 110 125 A T H 3X S+ 0 0 93 -4,-2.4 4,-2.8 1,-0.2 3,-0.4 0.919 112.8 42.0 -60.0 -45.0 21.5 15.2 -4.0 111 126 A A H S+ 0 0 65 -3,-0.4 4,-1.4 -2,-0.2 5,-0.1 0.851 81.1 49.3 -78.4 -36.4 15.0 8.4 -6.8 117 132 A E H > S+ 0 0 82 1,-0.2 4,-2.5 2,-0.2 3,-0.3 0.955 108.4 49.1 -69.9 -51.8 14.1 4.7 -6.7 118 133 A T H > S+ 0 0 56 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.708 109.0 60.2 -61.1 -17.7 17.1 3.4 -4.9 119 134 A F H > S+ 0 0 27 -4,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.930 107.7 39.8 -75.8 -48.3 16.5 6.2 -2.4 120 135 A L H X S+ 0 0 22 -4,-1.4 4,-2.5 -3,-0.3 5,-0.3 0.934 112.3 54.9 -67.2 -47.2 13.0 5.0 -1.4 121 136 A K H X S+ 0 0 56 -4,-2.5 4,-2.0 1,-0.3 -1,-0.2 0.813 106.5 55.8 -55.7 -27.5 13.9 1.3 -1.4 122 137 A K H X S+ 0 0 83 -4,-0.6 4,-2.7 -5,-0.3 -1,-0.3 0.924 108.3 46.3 -69.2 -46.0 16.6 2.4 1.0 123 138 A Y H X S+ 0 0 31 -4,-1.5 4,-2.8 -3,-0.2 5,-0.3 0.985 115.0 44.2 -58.2 -63.9 14.0 4.0 3.3 124 139 A L H X S+ 0 0 10 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.875 113.7 54.2 -49.0 -42.9 11.7 1.0 3.2 125 140 A Y H X S+ 0 0 6 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.964 111.7 41.6 -57.7 -56.4 14.7 -1.3 3.7 126 141 A E H X S+ 0 0 35 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.921 117.2 46.7 -59.9 -48.9 16.0 0.5 6.8 127 142 A I H X S+ 0 0 30 -4,-2.8 4,-1.6 1,-0.2 3,-0.4 0.926 113.0 48.7 -61.5 -46.0 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13.3-167.2-104.6 -54.3 30.9 1.3 37.9 489 504 A A S > S+ 0 0 41 1,-0.1 3,-1.0 4,-0.0 -2,-0.0 0.025 71.5 94.0 86.3 -29.1 32.1 4.7 36.6 490 505 A E G > S+ 0 0 141 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.797 78.0 65.8 -63.1 -23.8 32.6 3.3 33.1 491 506 A T G 3 S+ 0 0 63 1,-0.3 -1,-0.3 22,-0.0 22,-0.0 0.833 104.1 42.2 -63.7 -36.3 29.0 4.5 32.7 492 507 A F G < S+ 0 0 67 -3,-1.0 -1,-0.3 2,-0.0 -2,-0.2 0.121 75.3 148.7-101.8 20.1 30.2 8.1 33.0 493 508 A T < - 0 0 92 -3,-1.1 -3,-0.1 1,-0.1 61,-0.1 -0.362 57.4-106.5 -56.0 123.2 33.3 7.9 30.9 494 509 A F - 0 0 29 -2,-0.1 2,-0.3 56,-0.1 -1,-0.1 -0.120 39.7-175.1 -52.4 147.8 33.6 11.4 29.4 495 510 A H > - 0 0 104 -3,-0.1 3,-2.1 1,-0.1 4,-0.4 -0.925 31.5-127.5-149.6 123.8 32.8 11.8 25.7 496 511 A A G > S+ 0 0 67 -2,-0.3 3,-1.3 1,-0.3 4,-0.4 0.758 106.2 62.0 -36.9 -42.3 33.3 15.1 23.8 497 512 A D G > S+ 0 0 103 1,-0.2 3,-2.2 2,-0.2 -1,-0.3 0.865 84.0 78.9 -57.5 -38.6 29.7 15.0 22.5 498 513 A I G X S+ 0 0 53 -3,-2.1 3,-0.6 1,-0.3 -1,-0.2 0.762 94.0 47.8 -39.7 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-44.5 18.1 11.4 28.0 509 524 A K H X S+ 0 0 95 -4,-2.2 4,-3.3 1,-0.2 3,-0.3 0.981 113.3 50.5 -60.9 -53.5 21.6 11.2 29.5 510 525 A K H X S+ 0 0 53 -4,-2.8 4,-2.1 1,-0.3 -1,-0.2 0.827 110.7 48.7 -54.9 -33.7 20.3 12.7 32.7 511 526 A Q H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.3 0.863 110.6 51.2 -74.9 -32.9 17.5 10.1 32.8 512 527 A T H X S+ 0 0 41 -4,-2.2 4,-2.2 -3,-0.3 -2,-0.2 0.937 110.1 50.0 -64.1 -47.1 20.1 7.4 32.2 513 528 A A H X S+ 0 0 22 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.914 108.4 53.6 -57.6 -42.8 22.1 8.8 35.0 514 529 A L H X S+ 0 0 14 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.860 106.9 50.2 -63.3 -36.4 19.0 8.8 37.2 515 530 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.943 111.3 48.1 -67.5 -46.0 18.3 5.1 36.6 516 531 A E H X S+ 0 0 24 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.906 110.5 53.5 -59.1 -40.5 21.9 4.2 37.5 517 532 A L H X S+ 0 0 28 -4,-2.3 4,-2.3 -5,-0.2 3,-0.5 0.954 112.5 43.0 -57.9 -51.6 21.5 6.3 40.6 518 533 A V H < S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.808 110.9 54.1 -64.8 -34.0 18.4 4.4 41.6 519 534 A K H < S+ 0 0 11 -4,-2.5 -34,-2.7 1,-0.2 -1,-0.2 0.730 112.5 47.8 -72.2 -21.3 19.8 1.0 40.8 520 535 A H H < S+ 0 0 78 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.878 126.8 20.2 -86.5 -43.5 22.7 2.0 43.0 521 536 A K >< + 0 0 38 -4,-2.3 3,-1.8 -5,-0.1 -1,-0.2 -0.548 65.6 170.9-130.0 69.9 20.9 3.2 46.1 522 537 A P T 3 S+ 0 0 40 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.688 77.0 63.1 -49.9 -25.3 17.3 1.8 45.9 523 538 A K T 3 S+ 0 0 98 -3,-0.1 2,-0.1 2,-0.0 -5,-0.1 0.150 81.3 126.9 -90.5 20.6 16.6 3.1 49.5 524 539 A A < - 0 0 10 -3,-1.8 2,-0.3 -6,-0.2 -6,-0.0 -0.377 55.2-126.0 -80.6 158.2 17.1 6.7 48.4 525 540 A T > - 0 0 65 1,-0.1 4,-2.3 -2,-0.1 5,-0.3 -0.682 23.3-115.5-100.4 152.6 14.6 9.6 49.0 526 541 A K H > S+ 0 0 73 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.887 120.0 52.8 -51.6 -36.3 13.2 11.9 46.3 527 542 A E H > S+ 0 0 146 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.910 110.5 41.0 -67.2 -48.8 15.2 14.5 48.3 528 543 A Q H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.723 111.4 57.5 -76.7 -18.9 18.6 12.9 48.3 529 544 A L H X S+ 0 0 11 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.901 106.1 49.8 -74.6 -39.6 18.3 11.8 44.7 530 545 A K H X S+ 0 0 44 -4,-1.5 4,-3.0 -5,-0.3 5,-0.2 0.885 110.2 52.9 -63.6 -37.6 17.8 15.4 43.7 531 546 A A H X S+ 0 0 57 -4,-1.4 4,-2.3 2,-0.2 5,-0.2 0.957 111.4 42.8 -62.9 -52.7 20.9 16.3 45.7 532 547 A V H X S+ 0 0 76 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.862 117.2 48.9 -63.3 -35.8 23.1 13.7 44.0 533 548 A M H X S+ 0 0 23 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.979 110.5 48.3 -67.4 -56.2 21.7 14.6 40.6 534 549 A D H X S+ 0 0 99 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.895 113.3 47.8 -51.5 -46.9 22.1 18.4 41.0 535 550 A D H X S+ 0 0 63 -4,-2.3 4,-2.7 -5,-0.2 -1,-0.2 0.945 114.5 45.9 -61.3 -48.2 25.7 18.1 42.2 536 551 A F H X S+ 0 0 82 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.847 112.6 51.5 -64.3 -33.0 26.5 15.7 39.3 537 552 A A H X S+ 0 0 26 -4,-3.1 4,-1.9 2,-0.2 -1,-0.2 0.907 111.7 46.5 -69.1 -39.9 24.7 18.0 36.9 538 553 A A H X S+ 0 0 51 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.889 110.4 54.7 -68.0 -37.5 26.8 20.9 38.2 539 554 A F H X S+ 0 0 79 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.914 110.3 44.1 -61.8 -45.0 29.9 18.9 38.0 540 555 A V H X S+ 0 0 36 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.857 112.0 55.0 -69.7 -32.5 29.3 18.0 34.3 541 556 A E H X S+ 0 0 61 -4,-1.9 4,-0.7 2,-0.2 -2,-0.2 0.900 111.4 42.6 -67.1 -41.3 28.4 21.7 33.6 542 557 A K H >X S+ 0 0 159 -4,-2.3 3,-1.5 1,-0.2 4,-0.6 0.950 111.9 52.9 -70.8 -48.3 31.7 23.0 35.1 543 558 A q H >< S+ 0 0 2 -4,-2.3 3,-0.5 1,-0.3 -1,-0.2 0.781 107.2 53.9 -57.8 -26.9 33.8 20.4 33.4 544 559 A p H 3< S+ 0 0 32 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.708 86.6 77.9 -78.8 -21.4 32.2 21.3 30.1 545 560 A K H << S- 0 0 88 -3,-1.5 -1,-0.2 -4,-0.7 2,-0.2 0.824 99.4-164.1 -52.8 -29.9 33.2 25.0 30.7 546 561 A A << + 0 0 39 -4,-0.6 2,-0.6 -3,-0.5 -1,-0.2 -0.520 57.1 151.4 98.6-152.2 36.4 23.3 29.6 547 562 A D S S- 0 0 101 -2,-0.2 2,-0.8 -3,-0.2 3,-0.2 -0.970 103.5 -4.3 108.9-112.6 40.2 23.8 29.5 548 563 A D S >> S- 0 0 57 -2,-0.6 3,-2.7 1,-0.2 4,-1.3 -0.604 83.7-178.3-105.3 66.1 41.6 20.3 29.5 549 564 A K H >> S+ 0 0 75 -2,-0.8 4,-2.4 1,-0.3 3,-1.0 0.787 75.8 53.7 -29.1 -62.7 38.1 18.7 29.9 550 565 A E H 34 S+ 0 0 138 1,-0.3 4,-0.3 2,-0.2 -1,-0.3 0.767 108.2 52.9 -52.8 -26.7 39.2 15.1 30.1 551 566 A T H <4 S+ 0 0 105 -3,-2.7 -1,-0.3 2,-0.2 -2,-0.2 0.835 109.0 51.3 -76.1 -33.7 41.6 16.2 32.9 552 567 A q H << S+ 0 0 60 -4,-1.3 -2,-0.2 -3,-1.0 -3,-0.1 0.972 110.7 44.5 -65.8 -57.3 38.5 17.7 34.6 553 568 A F < 0 0 40 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.573 360.0 360.0 -65.6 -8.3 36.3 14.6 34.5 554 569 A A 0 0 116 -5,-0.3 -1,-0.2 -4,-0.3 -2,-0.2 0.911 360.0 360.0 -80.0 360.0 39.4 12.6 35.6