==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/IMMUNE SYSTEM 14-MAR-97 1AFV . COMPND 2 MOLECULE: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 CAPSID . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR C.MOMANY,L.C.KOVARI,A.J.PRONGAY,W.KELLER,R.K.GITTI,B.M.LEE, . 1176 6 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52580.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 805 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 332 28.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 . 2 0.2 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 . 149 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 4 0 4 0 0 2 0 0 0 2 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 2 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 . 9 10 15 4 7 11 4 0 3 1 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 3 5 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 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 P 0 0 37 0, 0.0 12,-1.5 0, 0.0 46,-0.3 0.000 360.0 360.0 360.0-173.5 23.4 35.0 110.2 2 2 A I + 0 0 14 44,-2.5 2,-1.1 43,-0.4 3,-0.3 0.177 360.0 69.5-167.6 -45.8 26.0 37.6 109.4 3 3 A V + 0 0 24 43,-2.1 43,-0.2 1,-0.2 44,-0.2 -0.151 65.0 122.5 -83.0 43.1 26.3 38.2 105.6 4 4 A Q S S- 0 0 78 -2,-1.1 42,-0.2 42,-0.3 -1,-0.2 0.994 100.1 -21.2 -67.4 -77.6 22.9 39.9 105.4 5 5 A N S S- 0 0 103 -3,-0.3 -1,-0.1 40,-0.1 -2,-0.1 -0.006 90.8-112.5-119.6 22.3 23.7 43.3 104.0 6 6 A L S S+ 0 0 104 -4,-0.3 2,-1.5 1,-0.2 -3,-0.1 0.384 86.8 123.2 61.7 -3.1 27.3 43.1 105.1 7 7 A Q + 0 0 125 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.165 57.0 80.6 -81.2 44.8 26.5 45.9 107.6 8 8 A G - 0 0 14 -2,-1.5 -6,-0.0 -6,-0.1 2,-0.0 -0.970 60.2-168.7-151.2 129.0 27.7 43.5 110.3 9 9 A Q S S- 0 0 127 -2,-0.3 -3,-0.1 110,-0.1 111,-0.0 0.305 78.3 -19.1 -90.6-129.7 31.3 42.9 111.3 10 10 A M S S+ 0 0 137 109,-0.1 109,-0.1 2,-0.0 108,-0.0 0.525 109.0 125.5 -57.4 -1.6 32.3 40.0 113.6 11 11 A V + 0 0 80 -9,-0.1 2,-0.3 104,-0.0 -3,-0.1 -0.220 33.4 161.3 -57.5 146.4 28.6 40.3 114.5 12 12 A H - 0 0 88 -10,-0.0 2,-0.3 -9,-0.0 -10,-0.2 -0.965 20.3-167.5-166.1 155.7 26.5 37.1 114.3 13 13 A Q - 0 0 145 -12,-1.5 2,-0.2 -2,-0.3 3,-0.1 -0.975 31.6-107.0-146.7 150.8 23.2 35.6 115.5 14 14 A A - 0 0 65 -2,-0.3 2,-0.1 1,-0.1 -2,-0.0 -0.610 55.7 -85.1 -79.0 144.3 21.8 32.1 115.5 15 15 A I - 0 0 5 -2,-0.2 197,-0.3 1,-0.1 -1,-0.1 -0.286 51.6-111.5 -54.0 117.3 19.0 31.6 113.0 16 16 A S >> - 0 0 49 1,-0.2 4,-2.3 -2,-0.1 3,-0.6 -0.301 16.7-130.9 -53.2 128.8 15.8 32.8 114.7 17 17 A P H 3> S+ 0 0 5 0, 0.0 4,-3.3 0, 0.0 5,-0.4 0.794 109.0 66.7 -53.0 -27.8 13.6 29.7 115.3 18 18 A R H 3> S+ 0 0 138 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.985 107.7 37.6 -56.3 -53.8 10.9 31.9 113.8 19 19 A T H <> S+ 0 0 45 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.887 118.5 48.6 -64.2 -45.0 12.8 31.7 110.5 20 20 A L H >X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 3,-0.6 0.969 112.0 47.7 -62.1 -53.2 13.9 28.1 110.9 21 21 A N H 3X S+ 0 0 30 -4,-3.3 4,-2.2 189,-0.3 -1,-0.2 0.854 108.0 59.2 -56.0 -34.7 10.4 26.9 111.8 22 22 A A H 3X S+ 0 0 33 -4,-1.8 4,-2.7 -5,-0.4 -1,-0.3 0.897 100.6 53.9 -61.6 -42.7 9.2 28.9 108.8 23 23 A W H < S- 0 0 78 -4,-2.6 3,-1.4 -5,-0.3 -3,-0.2 0.531 85.0-163.4-112.8 -8.8 4.5 23.5 99.4 31 31 A A T 3< - 0 0 55 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.178 64.9 -28.9 57.7-151.3 6.9 20.6 99.1 32 32 A F T 3 S+ 0 0 18 114,-0.1 -1,-0.2 3,-0.1 113,-0.1 -0.044 92.1 141.2 -88.4 32.6 9.6 20.9 96.4 33 33 A S S X S- 0 0 28 -3,-1.4 3,-2.9 1,-0.1 4,-0.3 -0.345 75.2 -91.4 -66.5 160.6 7.4 23.0 94.1 34 34 A P T > S+ 0 0 86 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.691 124.8 67.8 -48.2 -21.1 9.3 25.8 92.3 35 35 A E T 3> S+ 0 0 92 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.532 78.4 80.1 -80.6 -3.2 8.5 28.2 95.1 36 36 A V H <> S+ 0 0 0 -3,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.830 89.6 55.1 -71.5 -29.7 10.7 26.2 97.6 37 37 A I H <> S+ 0 0 30 -3,-0.8 4,-2.2 -4,-0.3 5,-0.2 0.960 106.5 46.4 -68.9 -54.1 13.8 27.9 96.2 38 38 A P H > S+ 0 0 78 0, 0.0 4,-2.1 0, 0.0 -2,-0.2 0.934 114.3 47.4 -55.3 -50.8 12.7 31.6 96.7 39 39 A M H X S+ 0 0 78 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.822 108.5 57.7 -61.5 -32.0 11.5 31.1 100.2 40 40 A F H < S+ 0 0 0 -4,-1.2 3,-0.3 2,-0.2 -1,-0.2 0.989 107.6 44.9 -60.9 -57.4 14.7 29.2 101.0 41 41 A S H >< S+ 0 0 42 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.849 111.6 54.3 -55.1 -38.2 16.9 32.2 100.0 42 42 A A H >< S+ 0 0 51 -4,-2.1 3,-0.9 1,-0.3 -1,-0.2 0.910 110.0 45.4 -63.9 -43.5 14.6 34.5 102.0 43 43 A L T 3< S+ 0 0 29 -4,-2.1 -1,-0.3 -3,-0.3 -2,-0.2 0.115 107.5 64.3 -87.1 23.4 15.0 32.4 105.1 44 44 A S T X + 0 0 1 -3,-1.4 3,-1.5 -5,-0.1 2,-0.5 0.055 67.8 174.1-132.8 25.1 18.7 32.3 104.5 45 45 A E T < S- 0 0 102 -3,-0.9 -43,-0.4 1,-0.3 -41,-0.2 -0.070 76.7 -50.5 -41.6 89.2 19.6 36.0 104.8 46 46 A G T 3 S+ 0 0 2 -2,-0.5 -44,-2.5 -43,-0.2 -43,-2.1 0.875 92.6 169.2 40.6 52.7 23.4 35.7 104.5 47 47 A A < - 0 0 2 -3,-1.5 84,-0.1 -46,-0.3 -1,-0.1 -0.284 37.7 -90.6 -86.5 176.3 23.6 33.0 107.2 48 48 A T > - 0 0 2 1,-0.1 4,-2.1 79,-0.1 5,-0.2 -0.556 38.2-107.6 -86.3 150.7 26.6 30.8 108.1 49 49 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.845 121.0 53.7 -46.0 -38.4 27.2 27.5 106.4 50 50 A Q H > S+ 0 0 27 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.970 105.5 51.2 -63.4 -51.7 26.1 25.7 109.6 51 51 A D H > S+ 0 0 7 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.876 112.6 48.2 -51.6 -40.6 22.7 27.6 109.8 52 52 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.951 109.9 50.4 -66.1 -46.9 22.2 26.6 106.2 53 53 A N H X S+ 0 0 45 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.852 109.2 53.9 -58.8 -35.5 23.1 22.9 107.0 54 54 A T H X S+ 0 0 1 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.960 108.4 48.3 -62.3 -53.0 20.6 23.1 109.9 55 55 A M H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.942 114.1 44.8 -51.7 -58.8 17.8 24.3 107.6 56 56 A L H < S+ 0 0 17 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.898 115.0 49.3 -52.5 -47.5 18.4 21.6 104.9 57 57 A N H >< S+ 0 0 30 -4,-2.3 3,-1.3 -5,-0.3 -1,-0.2 0.871 104.9 60.5 -61.2 -38.1 18.7 19.0 107.7 58 58 A T H 3< S+ 0 0 0 -4,-2.8 115,-0.3 1,-0.3 -2,-0.2 0.943 117.5 27.5 -57.3 -50.9 15.5 20.3 109.2 59 59 A V T 3< S+ 0 0 17 -4,-1.9 2,-1.7 1,-0.1 -1,-0.3 -0.074 76.2 131.3-107.3 37.7 13.4 19.5 106.2 60 60 A G < + 0 0 13 -3,-1.3 110,-0.1 1,-0.2 -1,-0.1 -0.195 29.2 160.6 -81.7 50.6 15.4 16.6 104.7 61 61 A G + 0 0 38 -2,-1.7 2,-0.4 1,-0.2 -1,-0.2 0.697 55.6 23.3 -42.6 -44.0 12.2 14.7 104.4 62 62 A H >> - 0 0 57 -3,-0.3 4,-1.6 1,-0.1 3,-0.7 -0.918 62.5-139.1-142.4 121.7 13.1 12.0 101.9 63 63 A Q H 3> S+ 0 0 164 -2,-0.4 4,-1.2 1,-0.2 5,-0.1 0.626 96.1 76.8 -44.3 -21.0 16.5 10.5 100.9 64 64 A A H >> S+ 0 0 65 2,-0.2 4,-1.1 1,-0.2 3,-0.7 0.991 108.4 21.5 -55.7 -70.8 15.3 10.6 97.3 65 65 A A H <> S+ 0 0 3 -3,-0.7 4,-2.4 1,-0.2 3,-0.3 0.897 117.0 65.8 -66.8 -41.7 15.7 14.4 96.7 66 66 A M H 3X S+ 0 0 41 -4,-1.6 4,-2.1 1,-0.3 -1,-0.2 0.775 100.3 54.6 -52.8 -26.0 18.2 14.8 99.5 67 67 A Q H < S+ 0 0 13 -4,-1.3 3,-1.9 1,-0.2 321,-0.3 0.893 102.3 61.8 -66.3 -38.5 38.8 22.8 95.0 82 82 A R H 3< S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.949 111.8 36.5 -52.1 -55.8 39.8 22.2 91.4 83 83 A L T 3< S+ 0 0 38 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.196 109.5 68.6 -84.1 14.7 40.3 25.9 90.7 84 84 A H < + 0 0 52 -3,-1.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.542 62.0 176.4-131.9 69.8 41.7 26.5 94.2 85 85 A P >> - 0 0 25 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.343 46.5-121.9 -56.2 -0.0 45.0 24.7 94.0 86 86 A V G >4 - 0 0 64 1,-0.2 3,-1.4 2,-0.1 -3,-0.0 0.781 47.8-109.7 54.1 26.8 45.9 25.8 97.5 87 87 A H G 34 S- 0 0 167 1,-0.3 -1,-0.2 3,-0.1 0, 0.0 0.615 85.5 -17.8 7.9 80.0 48.8 27.2 95.4 88 88 A A G <4 S- 0 0 95 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.1 0.568 123.4 -70.5 81.1 17.3 51.7 25.0 96.4 89 89 A G << - 0 0 29 -3,-1.4 2,-2.2 -4,-0.5 -3,-0.1 0.367 50.1 -83.1 80.2 146.8 50.0 23.9 99.6 90 90 A P - 0 0 68 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.513 58.9-155.6 -82.2 67.1 49.0 25.6 102.9 91 91 A I + 0 0 135 -2,-2.2 4,-0.1 -3,-0.1 -2,-0.1 -0.270 55.2 16.2 -53.4 126.4 52.5 25.0 104.3 92 92 A A S > S- 0 0 75 1,-0.1 3,-0.8 2,-0.1 2,-0.3 0.849 85.2-103.4 74.3 113.3 52.7 24.9 108.2 93 93 A P T 3 S+ 0 0 100 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.455 95.7 66.7 -65.9 120.3 49.7 24.4 110.5 94 94 A G T 3 + 0 0 85 1,-0.4 2,-0.2 -2,-0.3 -2,-0.1 0.150 68.5 111.6 154.4 -18.9 48.5 27.7 112.1 95 95 A Q S < S- 0 0 92 -3,-0.8 -1,-0.4 -5,-0.1 3,-0.0 -0.588 75.4-120.9 -83.2 143.1 47.3 29.8 109.2 96 96 A M - 0 0 81 -2,-0.2 -1,-0.1 -3,-0.1 21,-0.1 0.751 55.7-153.0 -50.7 -28.0 43.6 30.6 108.8 97 97 A R - 0 0 89 2,-0.1 -1,-0.1 -11,-0.0 3,-0.0 0.457 20.2 -71.6 64.6 153.9 43.8 28.8 105.4 98 98 A E - 0 0 95 1,-0.1 2,-0.1 -14,-0.0 -14,-0.0 -0.605 61.3-102.4 -75.6 133.0 41.9 29.2 102.2 99 99 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.386 38.0-149.5 -62.2 129.9 38.4 27.8 102.6 100 100 A R >> - 0 0 101 8,-0.1 4,-3.0 -2,-0.1 3,-1.0 -0.631 27.6-103.1 -97.2 161.1 38.0 24.4 101.0 101 101 A G H 3> S+ 0 0 0 -24,-0.4 4,-2.3 1,-0.3 6,-0.2 0.879 124.7 47.5 -49.2 -47.5 34.8 23.0 99.5 102 102 A S H 34>S+ 0 0 9 2,-0.2 6,-2.0 1,-0.2 5,-0.7 0.757 113.4 51.8 -66.5 -24.8 34.1 20.7 102.5 103 103 A D H X45S+ 0 0 6 -3,-1.0 3,-1.4 5,-0.2 -2,-0.2 0.946 109.7 45.4 -76.1 -50.4 34.8 23.8 104.6 104 104 A I H 3<5S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.861 112.4 54.3 -60.4 -34.9 32.4 26.1 102.8 105 105 A A T 3<5S- 0 0 7 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.631 116.5-119.3 -72.8 -17.0 29.9 23.2 102.9 106 106 A G T X 5S+ 0 0 5 -3,-1.4 3,-0.9 -4,-0.3 157,-0.4 0.101 86.6 105.6 101.5 -21.2 30.3 23.1 106.7 107 107 A T T 3 - 0 0 10 -2,-0.4 4,-2.4 152,-0.1 5,-0.2 -0.616 29.7-109.6 -87.3 154.9 34.0 25.0 112.7 111 111 A L H > S+ 0 0 23 147,-0.6 4,-1.8 150,-0.3 5,-0.1 0.890 122.4 50.6 -49.4 -42.9 31.3 27.6 113.5 112 112 A Q H > S+ 0 0 88 147,-1.4 4,-2.7 2,-0.2 -1,-0.3 0.925 107.5 53.6 -61.9 -43.7 34.1 30.0 114.6 113 113 A E H > S+ 0 0 45 146,-0.3 4,-2.1 1,-0.2 5,-0.2 0.941 106.0 51.8 -56.0 -51.0 36.0 29.4 111.4 114 114 A Q H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.884 110.0 50.4 -54.1 -40.0 33.0 30.2 109.2 115 115 A I H < S+ 0 0 14 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.951 106.2 56.3 -62.9 -48.5 32.7 33.5 111.2 116 116 A G H >< S+ 0 0 14 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.869 108.4 45.6 -51.5 -45.4 36.4 34.2 110.6 117 117 A W H >< S+ 0 0 7 -4,-2.1 7,-1.6 1,-0.2 3,-0.6 0.907 111.2 53.8 -66.9 -37.6 36.0 34.0 106.8 118 118 A M T 3< S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.426 114.9 42.1 -77.0 2.0 32.9 36.1 107.0 119 119 A T T < S+ 0 0 31 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.3 -0.479 95.2 99.0-146.2 66.6 34.8 38.8 108.9 120 120 A H S < S- 0 0 93 -3,-0.6 -3,-0.0 -111,-0.0 -4,-0.0 -0.982 81.0 -70.7-152.0 161.1 38.2 39.1 107.2 121 121 A N S S+ 0 0 125 -2,-0.3 -2,-0.0 1,-0.3 3,-0.0 -0.782 128.5 13.8 -86.5 104.1 40.3 41.1 104.8 122 122 A P S S- 0 0 111 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.847 104.2-123.5 -88.3 130.6 38.8 40.3 101.8 123 123 A P - 0 0 69 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.361 15.3-149.2 -57.9 115.5 35.6 38.7 103.2 124 124 A I - 0 0 44 -7,-1.6 2,-2.6 -2,-0.3 3,-0.3 -0.789 9.6-147.3 -87.0 105.9 35.2 35.1 101.9 125 125 A P >> + 0 0 40 0, 0.0 4,-3.0 0, 0.0 3,-0.5 -0.212 32.5 163.8 -72.2 55.9 31.4 34.7 101.8 126 126 A V H 3> S+ 0 0 0 -2,-2.6 4,-2.5 1,-0.3 5,-0.2 0.828 75.5 45.4 -42.1 -44.8 31.6 31.0 102.6 127 127 A G H 3> S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.906 114.0 47.8 -68.5 -42.1 27.9 30.9 103.5 128 128 A E H <> S+ 0 0 52 -3,-0.5 4,-0.9 2,-0.2 -2,-0.2 0.904 113.6 47.5 -64.9 -43.8 26.8 32.9 100.5 129 129 A I H >X S+ 0 0 8 -4,-3.0 4,-1.9 1,-0.2 3,-1.3 0.967 114.6 46.2 -61.9 -50.8 28.9 30.7 98.2 130 130 A Y H 3X S+ 0 0 9 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.857 107.1 58.9 -59.6 -36.2 27.5 27.6 99.8 131 131 A K H 3X S+ 0 0 15 -4,-2.3 4,-1.2 1,-0.2 -1,-0.3 0.736 105.3 51.1 -65.5 -24.8 24.0 29.1 99.6 132 132 A R H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 3,-0.5 0.942 107.9 52.3 -57.4 -49.3 22.6 24.4 97.5 135 135 A I H 3X S+ 0 0 38 -4,-1.2 4,-3.1 1,-0.3 5,-0.3 0.893 105.2 55.0 -56.3 -39.6 20.3 26.3 95.3 136 136 A L H 3X S+ 0 0 49 -4,-2.0 4,-0.8 1,-0.2 -1,-0.3 0.869 110.2 48.1 -62.0 -33.2 21.8 24.7 92.3 137 137 A G H < S+ 0 0 17 -4,-2.6 3,-1.3 1,-0.2 -2,-0.2 0.859 111.7 50.1 -41.8 -49.4 12.7 20.8 91.0 143 143 A R H 3< S+ 0 0 174 -4,-1.5 2,-0.5 1,-0.3 -1,-0.2 0.979 118.7 34.8 -56.5 -63.0 13.4 20.4 87.3 144 144 A M T 3< S+ 0 0 111 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 -0.080 135.0 23.6 -86.8 38.2 13.7 16.6 87.3 145 145 A Y S < S+ 0 0 115 -3,-1.3 -1,-0.2 -2,-0.5 3,-0.1 -0.211 89.8 83.9 162.4 96.5 11.0 16.2 89.9 146 146 A S S S+ 0 0 44 1,-0.6 -3,-0.1 -3,-0.2 -4,-0.1 0.122 72.2 46.6-165.9 -65.8 8.2 18.7 90.7 147 147 A P - 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0 0 2 -3,-1.3 84,-0.1 -46,-0.3 -1,-0.1 -0.272 37.8 -89.9 -85.8 174.5 24.2 12.2 118.9 200 48 B T > - 0 0 2 1,-0.1 4,-2.1 79,-0.1 3,-0.3 -0.510 37.7-107.6 -84.3 152.8 27.2 14.4 117.9 201 49 B P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.850 120.8 52.9 -46.8 -39.2 27.8 17.9 119.4 202 50 B Q H > S+ 0 0 39 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.942 105.5 51.7 -64.4 -48.4 26.8 19.5 116.1 203 51 B D H > S+ 0 0 10 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.891 112.3 48.3 -54.8 -40.4 23.4 17.6 115.9 204 52 B L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.953 110.1 49.8 -64.7 -48.5 22.8 18.8 119.4 205 53 B N H X S+ 0 0 39 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.859 109.2 54.6 -57.8 -35.4 23.7 22.4 118.5 206 54 B T H X S+ 0 0 5 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.969 108.6 47.7 -61.5 -53.4 21.4 22.0 115.6 207 55 B M H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.945 114.5 44.5 -52.3 -58.4 18.5 21.0 117.9 208 56 B L H < S+ 0 0 16 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.921 115.0 49.6 -52.2 -49.8 19.1 23.9 120.3 209 57 B N H >< S+ 0 0 21 -4,-2.6 3,-1.2 -5,-0.2 -1,-0.2 0.876 105.1 60.2 -58.2 -38.5 19.5 26.3 117.4 210 58 B T H 3< S+ 0 0 0 -4,-2.9 -189,-0.3 1,-0.3 -1,-0.2 0.908 118.1 26.8 -59.1 -45.5 16.2 24.9 115.9 211 59 B V T 3< S+ 0 0 13 -4,-1.9 2,-1.9 -3,-0.2 -1,-0.3 -0.050 75.4 131.3-112.6 36.7 14.1 25.9 118.9 212 60 B G < + 0 0 16 -3,-1.2 -194,-0.1 -197,-0.3 -1,-0.1 -0.229 30.4 163.6 -80.3 50.4 16.1 28.8 120.3 213 61 B G + 0 0 31 -2,-1.9 2,-0.4 1,-0.2 -1,-0.2 0.710 55.3 21.5 -38.7 -46.1 12.8 30.8 120.5 214 62 B H >> - 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