==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID BINDING PROTEIN 16-NOV-10 3PMD . COMPND 2 MOLECULE: CONSERVED DOMAIN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR G.R.STRANZL,E.SANTELLI,L.A.BANKSTON,C.LA CLAIR,A.BOBKOV, . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10368.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 79.1 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 . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 1 0 1 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 1 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 -2 A G 0 0 133 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 173.2 -19.6 67.7 10.8 2 -1 A S - 0 0 101 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.729 360.0-147.8 -82.9 -25.8 -20.0 65.8 7.5 3 0 A H - 0 0 170 1,-0.1 2,-0.1 2,-0.0 3,-0.1 0.943 22.0-168.3 55.5 54.8 -19.9 62.3 9.2 4 1 A M - 0 0 151 1,-0.1 -1,-0.1 2,-0.1 -2,-0.0 -0.471 38.1 -75.8 -75.0 148.0 -18.2 60.6 6.2 5 2 A E + 0 0 122 1,-0.1 -1,-0.1 -2,-0.1 4,-0.1 -0.145 68.0 144.5 -54.2 123.9 -18.1 56.8 6.2 6 3 A A > + 0 0 10 -3,-0.1 4,-3.0 2,-0.1 5,-0.3 0.217 25.3 116.0-144.2 13.4 -15.4 55.5 8.7 7 4 A T H > S+ 0 0 10 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.944 85.4 40.7 -60.5 -50.5 -16.7 52.3 10.3 8 5 A K H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.939 116.7 50.3 -59.9 -48.7 -14.1 50.0 8.9 9 6 A R H > S+ 0 0 146 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.895 111.6 47.6 -58.6 -45.2 -11.3 52.6 9.4 10 7 A Y H X S+ 0 0 111 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.857 109.9 53.0 -66.1 -36.7 -12.3 53.1 13.1 11 8 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.954 112.4 44.5 -61.3 -48.3 -12.5 49.4 13.8 12 9 A C H X S+ 0 0 10 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.866 111.6 54.1 -66.3 -36.8 -9.0 48.9 12.4 13 10 A L H X S+ 0 0 98 -4,-2.2 4,-2.8 -5,-0.2 5,-0.3 0.936 109.8 46.5 -60.2 -50.7 -7.8 51.9 14.4 14 11 A Y H X S+ 0 0 69 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.910 110.9 51.9 -59.2 -44.5 -9.1 50.6 17.7 15 12 A L H < S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.778 114.2 44.6 -69.1 -23.6 -7.6 47.1 17.1 16 13 A K H >< S+ 0 0 148 -4,-1.5 3,-0.8 -3,-0.3 -2,-0.2 0.925 120.0 37.8 -79.1 -48.3 -4.3 48.7 16.4 17 14 A E H 3< S+ 0 0 160 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.751 124.6 38.8 -79.5 -26.7 -4.2 51.2 19.3 18 15 A S T 3X S+ 0 0 16 -4,-2.8 4,-2.7 -5,-0.3 -1,-0.2 0.089 79.0 123.0-108.5 21.2 -5.9 49.0 21.9 19 16 A Q H <> S+ 0 0 50 -3,-0.8 4,-2.9 1,-0.2 5,-0.3 0.860 71.3 52.0 -51.4 -47.2 -4.1 45.8 20.7 20 17 A E H > S+ 0 0 171 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.928 113.3 44.4 -58.1 -47.1 -2.6 45.1 24.2 21 18 A K H > S+ 0 0 101 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.904 113.4 51.4 -63.0 -43.5 -6.0 45.3 25.9 22 19 A F H X S+ 0 0 8 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.929 113.4 42.8 -61.9 -47.4 -7.6 43.3 23.1 23 20 A I H X S+ 0 0 18 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.893 112.5 54.3 -66.7 -41.5 -5.1 40.4 23.4 24 21 A S H X S+ 0 0 56 -4,-2.5 4,-0.9 -5,-0.3 -2,-0.2 0.908 111.2 45.7 -56.0 -44.9 -5.1 40.5 27.2 25 22 A N H >< S+ 0 0 45 -4,-2.5 3,-0.6 1,-0.2 4,-0.3 0.883 110.8 52.3 -67.3 -39.3 -8.9 40.1 27.1 26 23 A W H >X S+ 0 0 19 -4,-2.1 3,-1.7 1,-0.2 4,-1.3 0.891 102.6 60.8 -63.7 -38.4 -8.7 37.3 24.5 27 24 A K H 3< S+ 0 0 129 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.813 98.7 57.6 -55.0 -31.8 -6.2 35.6 26.9 28 25 A K T << S+ 0 0 156 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.601 112.6 39.9 -76.1 -13.7 -8.9 35.4 29.6 29 26 A R T <4 S+ 0 0 71 -3,-1.7 -2,-0.2 -4,-0.3 -1,-0.2 0.618 91.1 100.9-114.4 -19.1 -11.2 33.5 27.3 30 27 A I < - 0 0 28 -4,-1.3 2,-0.7 -3,-0.1 56,-0.0 -0.299 67.7-122.0 -79.2 157.9 -9.1 31.0 25.3 31 28 A L + 0 0 65 55,-0.3 2,-0.4 -2,-0.0 59,-0.1 -0.866 41.3 163.3 -96.0 113.4 -8.6 27.2 25.9 32 29 A V - 0 0 56 -2,-0.7 2,-0.4 58,-0.0 3,-0.0 -1.000 29.9-137.8-137.6 134.5 -4.9 26.5 26.4 33 30 A H > - 0 0 84 -2,-0.4 3,-2.0 1,-0.1 6,-0.1 -0.775 16.3-131.1 -96.1 135.2 -3.4 23.3 27.9 34 31 A E T 3 S+ 0 0 149 -2,-0.4 -1,-0.1 1,-0.3 5,-0.1 0.830 105.9 45.6 -53.5 -37.7 -0.5 23.7 30.3 35 32 A H T 3 S+ 0 0 168 4,-0.1 -1,-0.3 3,-0.0 3,-0.0 0.242 76.3 127.3 -95.7 11.2 1.7 21.1 28.5 36 33 A D X - 0 0 7 -3,-2.0 3,-1.7 1,-0.2 4,-0.2 -0.576 52.8-150.0 -67.4 120.1 1.1 22.3 24.9 37 34 A P T 3 S+ 0 0 96 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.730 98.1 46.3 -70.5 -18.9 4.6 22.8 23.5 38 35 A Y T >> S+ 0 0 76 1,-0.2 3,-1.2 38,-0.2 4,-1.0 0.080 76.0 127.6-104.4 20.6 3.4 25.6 21.3 39 36 A K H X> S+ 0 0 76 -3,-1.7 3,-0.9 1,-0.3 4,-0.7 0.877 75.8 42.9 -41.3 -52.8 1.5 27.2 24.1 40 37 A N H 3> S+ 0 0 109 1,-0.2 4,-1.6 -3,-0.2 -1,-0.3 0.689 102.4 67.5 -79.1 -14.3 3.1 30.6 23.6 41 38 A E H <> S+ 0 0 52 -3,-1.2 4,-3.1 2,-0.2 -1,-0.2 0.740 90.6 65.8 -70.2 -22.7 2.8 30.4 19.8 42 39 A I H S+ 0 0 73 -4,-2.1 5,-2.8 2,-0.2 6,-0.6 0.890 109.5 48.2 -65.0 -40.0 -4.8 44.4 6.6 56 53 A Y H ><5S+ 0 0 21 -4,-2.3 3,-1.7 3,-0.2 -2,-0.2 0.914 109.6 51.9 -64.9 -42.7 -7.6 42.4 5.0 57 54 A M H 3<5S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.847 107.8 53.0 -64.7 -30.8 -10.2 44.9 6.1 58 55 A R T 3<5S- 0 0 150 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.345 117.3-116.0 -86.0 7.7 -8.1 47.6 4.5 59 56 A E T < 5S+ 0 0 129 -3,-1.7 -3,-0.2 2,-0.1 -2,-0.1 0.796 81.2 123.0 65.4 31.8 -8.1 45.7 1.2 60 57 A E S - 0 0 72 -2,-0.3 3,-0.8 -3,-0.1 4,-0.1 -0.535 34.2-102.0-102.2 173.6 -6.7 38.7 -0.1 63 60 A L G > S+ 0 0 43 1,-0.2 3,-1.7 -2,-0.2 4,-0.2 0.841 120.7 62.9 -65.1 -30.6 -8.2 35.7 1.6 64 61 A Q G > S+ 0 0 137 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.788 89.6 71.2 -66.1 -22.5 -5.6 33.4 -0.1 65 62 A D G < S+ 0 0 90 -3,-0.8 -1,-0.3 1,-0.3 4,-0.3 0.508 92.7 54.9 -73.3 -4.4 -3.0 35.4 1.8 66 63 A I G <> S+ 0 0 1 -3,-1.7 4,-2.1 -4,-0.1 -1,-0.3 0.385 82.8 88.5-102.1 4.9 -4.0 33.8 5.1 67 64 A E H <> S+ 0 0 71 -3,-1.5 4,-2.2 2,-0.2 5,-0.2 0.881 83.9 54.1 -72.7 -34.0 -3.6 30.2 3.8 68 65 A D H > S+ 0 0 141 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.939 111.4 43.9 -62.9 -48.0 0.1 30.0 4.7 69 66 A I H > S+ 0 0 19 -4,-0.3 4,-2.8 2,-0.2 5,-0.2 0.894 110.5 57.0 -65.4 -37.6 -0.5 31.0 8.4 70 67 A S H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.919 109.1 45.6 -56.2 -44.6 -3.5 28.6 8.4 71 68 A K H X S+ 0 0 118 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.891 110.9 53.0 -66.5 -39.3 -1.2 25.7 7.4 72 69 A K H X S+ 0 0 81 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.929 111.3 46.6 -59.1 -46.6 1.4 26.8 10.0 73 70 A I H X S+ 0 0 10 -4,-2.8 4,-2.8 2,-0.2 5,-0.2 0.928 110.4 52.9 -62.3 -45.1 -1.2 26.8 12.7 74 71 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.923 109.2 49.1 -58.0 -45.8 -2.5 23.4 11.6 75 72 A Q H X S+ 0 0 71 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.912 112.9 47.4 -58.9 -44.7 1.0 21.9 11.8 76 73 A E H X S+ 0 0 16 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.890 112.1 49.3 -66.3 -40.7 1.5 23.3 15.3 77 74 A R H X>S+ 0 0 15 -4,-2.8 5,-1.2 2,-0.2 4,-0.7 0.898 111.6 49.3 -65.9 -40.3 -1.9 22.1 16.5 78 75 A M H ><5S+ 0 0 15 -4,-2.6 3,-0.9 -5,-0.2 -2,-0.2 0.924 112.4 47.3 -63.6 -44.6 -1.2 18.6 15.1 79 76 A D H 3<5S+ 0 0 73 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.845 107.8 57.3 -64.6 -34.5 2.3 18.5 16.8 80 77 A A H 3<5S- 0 0 14 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.674 99.5-140.5 -68.1 -20.6 0.7 19.7 20.0 81 78 A K T <<5 + 0 0 168 -3,-0.9 2,-0.3 -4,-0.7 -3,-0.2 0.850 53.0 139.2 55.4 39.7 -1.7 16.7 20.0 82 79 A V < - 0 0 18 -5,-1.2 -1,-0.2 1,-0.1 2,-0.2 -0.760 68.1 -83.7-105.6 155.8 -4.6 18.8 21.2 83 80 A N > - 0 0 109 -2,-0.3 3,-1.9 1,-0.2 4,-0.4 -0.444 34.4-139.6 -58.3 124.1 -8.1 18.6 20.0 84 81 A I T >> S+ 0 0 28 1,-0.3 4,-0.9 -2,-0.2 3,-0.7 0.694 97.8 74.9 -65.5 -18.2 -8.2 20.8 16.8 85 82 A A H 3> S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.775 81.6 69.2 -62.3 -26.2 -11.7 22.1 18.0 86 83 A D H <> S+ 0 0 18 -3,-1.9 4,-3.0 1,-0.2 -55,-0.3 0.898 95.9 53.9 -56.5 -43.2 -9.8 24.2 20.6 87 84 A F H <> S+ 0 0 15 -3,-0.7 4,-2.5 -4,-0.4 -1,-0.2 0.887 107.7 49.2 -57.1 -42.8 -8.5 26.3 17.6 88 85 A I H X S+ 0 0 55 -4,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.943 112.7 48.2 -64.0 -46.5 -12.1 26.8 16.4 89 86 A Y H X S+ 0 0 111 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.932 113.6 45.9 -58.9 -49.3 -13.2 27.9 19.9 90 87 A N H X S+ 0 0 10 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.879 112.7 50.1 -65.5 -38.6 -10.2 30.2 20.4 91 88 A T H X S+ 0 0 16 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.929 110.1 51.7 -63.0 -43.5 -10.7 31.8 16.9 92 89 A N H X S+ 0 0 65 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.835 105.7 53.6 -65.6 -35.1 -14.4 32.3 17.7 93 90 A E H X S+ 0 0 12 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.909 109.8 49.3 -63.1 -42.6 -13.6 34.0 20.9 94 91 A G H X S+ 0 0 9 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.942 112.1 47.0 -60.4 -47.4 -11.4 36.4 19.0 95 92 A K H X S+ 0 0 35 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.899 108.5 55.6 -61.5 -41.7 -14.1 37.1 16.4 96 93 A K H X S+ 0 0 100 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.904 108.8 48.2 -58.2 -39.4 -16.7 37.6 19.1 97 94 A E H X S+ 0 0 5 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.871 109.2 52.2 -72.6 -37.4 -14.5 40.3 20.6 98 95 A I H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.941 112.0 47.0 -62.5 -44.2 -13.9 42.0 17.2 99 96 A L H X S+ 0 0 31 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.910 107.0 56.2 -66.6 -39.7 -17.7 42.1 16.7 100 97 A N H X S+ 0 0 84 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.933 109.6 47.9 -53.5 -45.2 -18.2 43.5 20.2 101 98 A T H >< S+ 0 0 12 -4,-2.1 3,-0.5 1,-0.2 4,-0.5 0.907 108.2 53.8 -62.6 -44.3 -15.8 46.3 19.3 102 99 A L H >< S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.919 106.1 52.8 -55.2 -45.5 -17.7 47.0 16.0 103 100 A F H >< S+ 0 0 97 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.758 97.8 65.2 -68.2 -23.3 -21.0 47.3 17.8 104 101 A L T << S+ 0 0 136 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.609 91.2 65.3 -72.4 -13.4 -19.5 49.9 20.1 105 102 A L T < S- 0 0 59 -3,-1.7 -1,-0.3 -4,-0.5 -2,-0.2 0.387 109.1-128.0 -81.7 2.6 -19.1 52.2 17.0 106 103 A N < - 0 0 142 -3,-1.5 -3,-0.1 1,-0.1 -2,-0.1 0.928 35.9-166.3 47.0 55.8 -22.9 52.2 16.8 107 104 A P - 0 0 23 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.317 17.3-116.6 -67.0 152.6 -23.1 51.1 13.2 108 105 A T > - 0 0 75 1,-0.1 4,-2.9 4,-0.0 5,-0.2 -0.363 35.4 -98.8 -72.7 165.9 -26.2 51.4 11.1 109 106 A G H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.893 127.7 48.5 -51.2 -43.4 -27.9 48.3 9.8 110 107 A Q H > S+ 0 0 125 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 109.8 49.6 -66.0 -43.8 -26.3 49.0 6.4 111 108 A E H > S+ 0 0 30 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.893 110.6 52.9 -63.9 -41.3 -22.8 49.6 8.0 112 109 A C H X S+ 0 0 25 -4,-2.9 4,-2.7 2,-0.2 5,-0.5 0.935 107.5 50.9 -53.7 -50.0 -23.3 46.3 9.9 113 110 A K H X S+ 0 0 111 -4,-2.1 4,-2.1 1,-0.2 5,-0.2 0.963 114.9 41.4 -56.8 -52.6 -24.1 44.4 6.6 114 111 A V H X S+ 0 0 74 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.919 122.3 37.6 -63.3 -46.8 -21.0 45.6 4.8 115 112 A V H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.932 117.3 49.4 -76.7 -44.6 -18.5 45.3 7.7 116 113 A I H X S+ 0 0 37 -4,-2.7 4,-3.0 -5,-0.3 5,-0.2 0.889 106.8 56.0 -62.9 -40.7 -19.9 42.1 9.2 117 114 A E H X S+ 0 0 98 -4,-2.1 4,-2.0 -5,-0.5 -1,-0.2 0.913 111.0 45.1 -58.0 -38.5 -20.0 40.3 5.8 118 115 A Q H X S+ 0 0 19 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.898 111.7 50.9 -71.9 -41.7 -16.2 41.1 5.4 119 116 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.932 111.3 50.4 -58.8 -44.2 -15.4 40.0 9.0 120 117 A N H X S+ 0 0 51 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.899 106.3 53.6 -60.2 -43.6 -17.3 36.8 8.3 121 118 A L H X S+ 0 0 94 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.927 111.4 47.4 -59.5 -41.9 -15.4 36.1 5.0 122 119 A F H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.957 117.5 38.0 -65.8 -53.6 -12.1 36.4 6.9 123 120 A F H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.875 114.3 55.0 -71.3 -36.0 -12.8 34.2 9.9 124 121 A D H X S+ 0 0 99 -4,-2.8 4,-2.8 -5,-0.3 -1,-0.2 0.935 113.1 43.9 -56.9 -45.5 -14.8 31.7 7.8 125 122 A H H X S+ 0 0 36 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 0.859 110.9 53.7 -70.8 -37.0 -11.8 31.3 5.5 126 123 A L H X S+ 0 0 2 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.945 115.4 40.1 -59.3 -48.0 -9.3 31.2 8.4 127 124 A I H X S+ 0 0 30 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.939 117.2 48.2 -69.7 -47.1 -11.2 28.4 10.0 128 125 A Y H X S+ 0 0 142 -4,-2.8 4,-2.7 -5,-0.3 -2,-0.2 0.948 114.8 46.0 -54.8 -50.0 -11.9 26.6 6.7 129 126 A S H X S+ 0 0 6 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.871 112.5 49.1 -65.6 -40.6 -8.3 26.8 5.6 130 127 A T H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 0.921 115.1 43.5 -68.3 -44.0 -6.8 25.7 8.9 131 128 A I H X S+ 0 0 56 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.898 112.4 54.1 -66.7 -40.5 -9.1 22.7 9.2 132 129 A Y H X S+ 0 0 113 -4,-2.7 4,-2.1 -5,-0.3 -2,-0.2 0.954 113.0 43.2 -54.7 -51.7 -8.5 21.9 5.5 133 130 A S H X S+ 0 0 18 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.894 112.4 52.9 -62.2 -43.1 -4.7 21.9 6.1 134 131 A Y H X S+ 0 0 31 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.937 108.4 51.1 -59.5 -45.8 -5.0 19.9 9.4 135 132 A Y H X S+ 0 0 139 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.925 112.7 45.1 -56.7 -49.5 -7.0 17.2 7.6 136 133 A K H X S+ 0 0 110 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.875 113.6 49.3 -65.7 -40.4 -4.5 16.8 4.8 137 134 A L H X S+ 0 0 31 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.909 111.9 48.5 -67.6 -40.9 -1.5 16.9 7.3 138 135 A K H X S+ 0 0 76 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.879 109.5 53.2 -65.2 -37.9 -3.2 14.2 9.5 139 136 A K H X S+ 0 0 119 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.925 111.9 44.8 -62.2 -43.6 -3.9 12.1 6.4 140 137 A E H X S+ 0 0 109 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.875 111.2 54.3 -68.4 -36.1 -0.3 12.2 5.4 141 138 A Y H X S+ 0 0 59 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.920 109.2 47.4 -65.0 -43.1 0.8 11.5 9.1 142 139 A I H X S+ 0 0 91 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.924 113.9 47.0 -64.9 -45.0 -1.3 8.4 9.2 143 140 A H H < S+ 0 0 149 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.873 116.2 45.6 -63.4 -39.5 0.0 7.2 5.9 144 141 A S H < S+ 0 0 62 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.891 127.1 21.7 -69.3 -43.6 3.6 7.9 6.8 145 142 A Y H < S+ 0 0 169 -4,-2.4 2,-0.3 -5,-0.2 -3,-0.2 0.583 112.1 61.2-110.0 -14.5 3.8 6.5 10.3 146 143 A Y < - 0 0 150 -4,-2.2 2,-0.3 -5,-0.3 0, 0.0 -0.780 48.9-167.0-122.3 159.9 1.0 3.9 10.7 147 144 A E - 0 0 178 -2,-0.3 2,-0.1 -3,-0.0 3,-0.1 -0.976 36.6 -96.3-136.1 151.3 -0.2 0.6 9.2 148 145 A L - 0 0 122 -2,-0.3 5,-0.1 1,-0.1 2,-0.1 -0.447 44.6-107.3 -63.7 136.6 -3.5 -1.2 9.5 149 146 A K > - 0 0 145 -2,-0.1 3,-1.7 1,-0.1 4,-0.3 -0.404 30.0-117.0 -57.2 142.2 -3.5 -4.0 12.1 150 147 A K G > S+ 0 0 176 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.854 111.1 68.8 -53.3 -41.1 -3.5 -7.4 10.4 151 148 A K G 3 S+ 0 0 150 1,-0.3 -1,-0.3 0, 0.0 -2,-0.0 0.778 105.0 43.3 -50.0 -30.7 -6.9 -8.2 11.9 152 149 A Y G < 0 0 154 -3,-1.7 -1,-0.3 0, 0.0 -2,-0.2 0.378 360.0 360.0-101.5 4.2 -8.4 -5.6 9.6 153 150 A N < 0 0 159 -3,-2.2 -3,-0.0 -4,-0.3 0, 0.0 -0.857 360.0 360.0-111.9 360.0 -6.5 -6.2 6.3