==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECOMBINATION/DNA 15-DEC-09 3L2U . COMPND 2 MOLECULE: INTEGRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN SPUMARETROVIRUS; . AUTHOR S.HARE,S.S.GUPTA,P.CHEREPANOV . 528 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27886.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 325 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 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 . 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 . 25 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 143 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 2 0 3 0 0 2 2 3 0 3 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 1 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 0 PARALLEL BRIDGES PER LADDER . 4 2 1 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 3 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 10 A A >> 0 0 130 0, 0.0 3,-2.1 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -61.1 -81.1 16.1 -61.4 2 11 A E T 34 + 0 0 68 1,-0.3 4,-0.0 2,-0.1 0, 0.0 0.293 360.0 59.8 -66.5 12.6 -81.3 19.6 -60.0 3 12 A L T 3> S+ 0 0 20 2,-0.1 4,-0.9 3,-0.1 -1,-0.3 0.496 86.2 72.2-116.2 -9.1 -79.8 21.0 -63.2 4 13 A D H X> S+ 0 0 99 -3,-2.1 4,-1.1 1,-0.2 3,-0.7 0.967 96.8 47.0 -69.3 -52.9 -82.4 19.8 -65.8 5 14 A Q H 3<>S+ 0 0 69 -4,-0.5 5,-2.9 1,-0.2 -1,-0.2 0.670 102.9 65.8 -68.4 -18.4 -85.2 22.3 -64.9 6 15 A L H >45S+ 0 0 8 2,-0.2 3,-1.2 1,-0.2 15,-0.3 0.887 102.8 45.1 -71.1 -42.2 -82.8 25.2 -64.8 7 16 A L H <<5S+ 0 0 68 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.787 107.7 61.0 -65.5 -29.5 -82.1 24.9 -68.6 8 17 A Q T 3<5S- 0 0 115 -4,-1.1 -1,-0.3 2,-0.1 -2,-0.2 0.402 122.2-111.9 -79.4 2.6 -85.9 24.5 -68.8 9 18 A G T < 5 + 0 0 42 -3,-1.2 -3,-0.2 1,-0.3 2,-0.1 0.511 69.0 142.1 81.9 6.8 -86.1 28.0 -67.3 10 19 A H < - 0 0 114 -5,-2.9 2,-0.3 1,-0.1 -1,-0.3 -0.474 55.2-103.6 -79.7 151.9 -87.6 27.0 -63.9 11 20 A Y - 0 0 163 -2,-0.1 2,-0.4 6,-0.0 -1,-0.1 -0.578 31.9-172.6 -80.0 134.6 -86.6 28.8 -60.7 12 21 A I > - 0 0 25 3,-0.5 3,-2.9 -2,-0.3 -10,-0.0 -0.979 39.2-101.9-127.7 117.2 -84.2 27.0 -58.3 13 22 A K T 3 S+ 0 0 84 -2,-0.4 -2,-0.0 1,-0.3 0, 0.0 -0.044 109.0 20.3 -40.4 116.6 -83.6 28.7 -54.9 14 23 A G T 3 S+ 0 0 38 1,-0.1 -1,-0.3 59,-0.0 61,-0.1 0.131 96.2 100.4 108.6 -20.4 -80.2 30.4 -55.2 15 24 A Y S < S- 0 0 10 -3,-2.9 -3,-0.5 59,-0.1 -1,-0.1 -0.850 70.9-134.7-102.5 104.7 -79.8 30.7 -59.0 16 25 A P > - 0 0 48 0, 0.0 3,-0.7 0, 0.0 2,-0.2 -0.338 13.5-140.2 -60.6 123.8 -80.7 34.2 -60.0 17 26 A K T 3 S+ 0 0 150 1,-0.2 3,-0.1 -2,-0.1 -6,-0.0 -0.577 81.7 69.5 -77.7 153.3 -83.0 34.3 -63.1 18 27 A Q T 3 S+ 0 0 159 1,-0.5 2,-0.5 -2,-0.2 -1,-0.2 0.027 84.3 87.3 114.4 -17.9 -82.1 37.1 -65.6 19 28 A Y S < S- 0 0 55 -3,-0.7 -1,-0.5 -4,-0.0 2,-0.4 -0.947 85.1-124.0-104.8 132.0 -78.9 35.3 -66.5 20 29 A T - 0 0 111 -2,-0.5 11,-1.0 11,-0.2 2,-0.9 -0.668 14.9-153.3 -85.0 130.2 -79.4 32.7 -69.3 21 30 A Y + 0 0 23 -2,-0.4 9,-0.2 -15,-0.3 -12,-0.2 -0.736 28.6 166.4-104.3 83.2 -78.4 29.1 -68.4 22 31 A F - 0 0 71 -2,-0.9 7,-2.2 7,-0.4 2,-0.4 -0.009 29.3-115.0 -85.3-168.7 -77.5 27.5 -71.7 23 32 A L E +A 28 0A 104 5,-0.2 2,-0.3 -16,-0.1 5,-0.2 -0.996 31.3 161.8-136.4 136.5 -75.6 24.2 -72.6 24 33 A E E > S-A 27 0A 96 3,-1.6 3,-2.4 -2,-0.4 -2,-0.0 -0.958 72.5 -0.9-151.4 140.4 -72.3 23.5 -74.5 25 34 A D T 3 S- 0 0 137 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.667 125.4 -65.3 56.0 20.0 -70.1 20.3 -74.5 26 35 A G T 3 S+ 0 0 67 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.786 111.7 117.6 68.8 28.5 -72.6 18.7 -72.1 27 36 A K E < -A 24 0A 106 -3,-2.4 -3,-1.6 13,-0.0 2,-0.4 -0.992 69.9-118.7-123.2 135.7 -71.8 21.2 -69.4 28 37 A V E -AB 23 39A 17 11,-0.5 11,-2.9 -2,-0.4 2,-0.3 -0.577 40.0-170.5 -70.9 125.8 -74.3 23.7 -67.9 29 38 A K E - B 0 38A 31 -7,-2.2 -7,-0.4 -2,-0.4 2,-0.4 -0.879 14.6-161.7-121.8 154.8 -73.1 27.2 -68.5 30 39 A V E - B 0 37A 0 7,-2.6 7,-2.4 -2,-0.3 2,-0.8 -0.990 19.3-131.7-133.6 145.4 -74.1 30.7 -67.4 31 40 A S E + B 0 36A 57 -11,-1.0 5,-0.2 -2,-0.4 -11,-0.2 -0.832 37.1 178.7 -96.7 106.4 -73.3 34.1 -68.8 32 41 A R E > - B 0 35A 61 3,-3.7 3,-1.6 -2,-0.8 -2,-0.0 -0.787 45.5-108.4-113.5 150.9 -72.1 36.4 -66.0 33 42 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.873 124.1 48.1 -30.6 -54.1 -70.9 40.0 -65.7 34 43 A E T 3 S- 0 0 92 1,-0.1 2,-0.3 -3,-0.0 -3,-0.0 0.718 128.3 -82.5 -67.0 -26.3 -67.4 38.5 -65.1 35 44 A G E < -B 32 0A 26 -3,-1.6 -3,-3.7 2,-0.0 2,-0.6 -0.995 64.5 -36.5 159.3-155.5 -67.6 36.1 -68.1 36 45 A V E -B 31 0A 85 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.929 62.0-174.3-103.7 115.0 -69.0 32.7 -69.2 37 46 A K E -B 30 0A 28 -7,-2.4 -7,-2.6 -2,-0.6 2,-0.4 -0.838 24.1-124.3-115.0 149.0 -68.7 30.2 -66.4 38 47 A I E -Bc 29 71A 36 32,-2.6 34,-2.0 -2,-0.3 -9,-0.2 -0.735 18.3-148.8 -83.8 129.6 -69.4 26.4 -66.0 39 48 A I E -B 28 0A 2 -11,-2.9 -11,-0.5 -2,-0.4 34,-0.1 -0.899 16.8-154.7 -97.5 112.7 -71.8 25.4 -63.3 40 49 A P - 0 0 6 0, 0.0 5,-0.1 0, 0.0 -13,-0.0 -0.527 25.4 -95.2 -84.2 156.4 -70.8 22.0 -62.0 41 50 A P >> - 0 0 54 0, 0.0 3,-1.2 0, 0.0 4,-0.9 -0.345 37.2-107.2 -66.5 150.8 -73.2 19.6 -60.4 42 51 A Q H >> S+ 0 0 112 1,-0.3 3,-1.2 2,-0.2 4,-0.7 0.848 118.5 54.5 -40.3 -50.7 -73.5 19.6 -56.6 43 52 A S H 34 S+ 0 0 103 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.812 108.3 49.8 -61.2 -32.7 -71.7 16.2 -56.3 44 53 A D H <> S+ 0 0 59 -3,-1.2 4,-2.0 1,-0.1 -1,-0.3 0.672 94.5 79.1 -75.1 -18.6 -68.7 17.5 -58.3 45 54 A R H S+ 0 0 100 -4,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.953 107.5 51.6 -54.0 -50.9 -64.0 17.8 -55.3 48 57 A I H X S+ 0 0 13 -4,-2.0 4,-2.0 2,-0.2 3,-0.2 0.921 111.2 47.0 -54.8 -51.1 -63.5 21.0 -57.4 49 58 A V H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 3,-0.4 0.970 107.8 54.0 -53.6 -61.7 -62.7 23.1 -54.3 50 59 A L H X S+ 0 0 75 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.830 110.4 49.9 -43.1 -38.7 -60.3 20.6 -52.7 51 60 A Q H X S+ 0 0 114 -4,-1.8 4,-0.6 -3,-0.2 -1,-0.2 0.892 110.5 47.0 -71.0 -45.8 -58.4 20.7 -56.0 52 61 A A H >< S+ 0 0 11 -4,-2.0 3,-1.5 -3,-0.4 4,-0.4 0.973 116.0 46.5 -56.4 -57.5 -58.2 24.4 -56.2 53 62 A H H >X>S+ 0 0 4 -4,-2.9 4,-2.4 1,-0.3 3,-1.0 0.880 105.5 60.2 -54.8 -41.5 -57.1 24.6 -52.6 54 63 A N H 3<5S+ 0 0 75 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.601 82.5 81.1 -70.7 -8.3 -54.6 21.8 -52.9 55 64 A L T <<5S- 0 0 128 -3,-1.5 -1,-0.2 -4,-0.6 -2,-0.1 0.934 129.4 -17.3 -61.8 -43.2 -52.5 23.7 -55.5 56 65 A A T <45S- 0 0 75 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.211 92.8-106.3-143.6 7.7 -50.8 25.7 -52.8 57 66 A H T <5 - 0 0 56 -4,-2.4 -3,-0.2 -5,-0.2 -4,-0.1 0.896 57.4-176.0 65.4 43.1 -53.1 25.3 -49.8 58 67 A T < - 0 0 41 -5,-0.8 -1,-0.2 -6,-0.3 32,-0.1 -0.343 20.7-114.6 -77.8 150.1 -54.4 28.8 -50.2 59 68 A G > - 0 0 36 -2,-0.1 4,-2.4 4,-0.1 5,-0.3 0.182 50.0 -66.8 -65.5-167.8 -56.8 30.6 -47.9 60 69 A R H > S+ 0 0 129 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.888 127.2 33.5 -57.0 -56.3 -60.4 31.8 -48.7 61 70 A E H > S+ 0 0 71 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.930 118.6 51.4 -72.7 -43.2 -59.9 34.5 -51.2 62 71 A A H > S+ 0 0 50 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.860 114.4 44.4 -62.6 -38.2 -56.9 33.1 -52.9 63 72 A T H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 3,-0.4 0.951 112.1 52.6 -68.5 -50.3 -58.7 29.7 -53.4 64 73 A L H X S+ 0 0 13 -4,-2.4 4,-3.0 -5,-0.3 5,-0.2 0.924 104.0 56.5 -51.8 -49.3 -61.9 31.4 -54.5 65 74 A L H X S+ 0 0 111 -4,-2.9 4,-0.6 1,-0.2 -1,-0.2 0.865 107.4 49.2 -53.3 -42.1 -60.1 33.4 -57.2 66 75 A K H >X S+ 0 0 121 -4,-1.1 3,-1.5 -3,-0.4 4,-0.6 0.967 113.4 45.2 -56.7 -56.7 -58.7 30.2 -58.8 67 76 A I H >X S+ 0 0 6 -4,-2.0 4,-2.5 1,-0.3 3,-0.8 0.867 103.9 64.1 -57.0 -40.5 -62.1 28.5 -58.8 68 77 A A H 3< S+ 0 0 35 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.692 88.3 72.4 -64.0 -17.7 -63.8 31.6 -60.2 69 78 A N H << S+ 0 0 106 -3,-1.5 -1,-0.2 -4,-0.6 -2,-0.2 0.973 118.2 10.3 -59.2 -51.3 -61.8 31.3 -63.4 70 79 A L H << S+ 0 0 106 -3,-0.8 -32,-2.6 -4,-0.6 2,-0.3 0.852 123.0 47.0 -97.9 -39.0 -63.6 28.3 -64.7 71 80 A Y B < -c 38 0A 61 -4,-2.5 2,-0.3 -34,-0.2 -32,-0.2 -0.685 45.9-173.6-115.9 156.6 -66.7 27.8 -62.5 72 81 A W + 0 0 37 -34,-2.0 -4,-0.0 -2,-0.3 -3,-0.0 -0.970 18.3 144.8-133.8 152.4 -69.6 29.5 -60.9 73 82 A W > - 0 0 1 -2,-0.3 3,-0.5 -34,-0.1 2,-0.2 -0.933 53.5 -70.8-164.5 176.4 -72.3 28.3 -58.5 74 83 A P T 3 S+ 0 0 20 0, 0.0 -59,-0.1 0, 0.0 -2,-0.0 -0.542 108.9 3.4 -80.9 145.5 -74.2 29.8 -55.6 75 84 A N T 3> S+ 0 0 130 -2,-0.2 4,-1.1 -61,-0.1 0, 0.0 0.946 72.8 169.5 54.6 57.6 -72.5 30.5 -52.3 76 85 A M H X> S+ 0 0 16 -3,-0.5 4,-1.6 1,-0.2 3,-0.5 0.939 71.5 54.6 -65.4 -48.7 -69.1 29.5 -53.5 77 86 A R H 3> S+ 0 0 108 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.856 100.2 62.5 -60.4 -32.3 -67.2 30.9 -50.5 78 87 A K H 3> S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.940 107.2 42.6 -56.3 -48.3 -69.4 28.8 -48.2 79 88 A D H < S+ 0 0 21 -4,-1.5 3,-1.2 -3,-0.4 4,-0.4 0.866 107.9 54.3 -68.2 -41.0 -63.1 22.8 -47.0 84 93 A L H >< S+ 0 0 7 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.806 102.2 59.3 -64.6 -30.6 -60.5 25.0 -45.3 85 94 A G T 3< S+ 0 0 23 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.679 109.4 44.9 -68.9 -17.6 -62.0 24.0 -41.9 86 95 A R T < S+ 0 0 201 -3,-1.2 2,-1.3 -4,-0.4 -1,-0.2 0.335 80.7 109.9-110.8 -0.0 -61.2 20.3 -42.8 87 96 A C <> - 0 0 13 -3,-0.8 4,-2.3 -4,-0.4 5,-0.2 -0.688 49.0-167.4 -81.4 94.7 -57.7 20.7 -44.2 88 97 A Q H > S+ 0 0 100 -2,-1.3 4,-2.0 1,-0.2 5,-0.2 0.905 83.9 54.3 -42.6 -52.3 -55.6 19.1 -41.5 89 98 A Q H > S+ 0 0 113 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.895 110.3 41.8 -58.1 -53.8 -52.4 20.5 -43.1 90 99 A C H >> S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 3,-0.7 0.935 110.3 58.1 -58.3 -49.0 -53.4 24.2 -43.1 91 100 A L H 3< S+ 0 0 16 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.891 114.9 36.8 -47.7 -45.7 -55.0 24.0 -39.6 92 101 A I H 3< S+ 0 0 30 -4,-2.0 236,-1.5 -5,-0.2 -1,-0.3 0.617 125.3 39.3 -86.2 -11.3 -51.6 22.9 -38.1 93 102 A T H << S+ 0 0 76 -4,-1.1 234,-0.3 -3,-0.7 -3,-0.2 0.871 90.0 87.4-105.2 -46.5 -49.4 25.0 -40.3 94 103 A N S < S- 0 0 85 -4,-2.3 2,-0.0 -5,-0.2 233,-0.0 -0.093 73.2-118.0 -54.5 151.4 -50.9 28.5 -40.9 95 104 A A - 0 0 81 1,-0.1 2,-0.2 2,-0.0 -1,-0.1 -0.256 29.0 -99.0 -82.9 172.9 -50.2 31.3 -38.4 96 105 A S - 0 0 48 1,-0.1 -1,-0.1 2,-0.1 3,-0.1 -0.497 21.2-169.7 -80.1 157.2 -52.8 33.2 -36.3 97 106 A N + 0 0 116 -2,-0.2 2,-0.4 1,-0.1 -1,-0.1 0.036 69.1 81.4-128.9 26.4 -54.1 36.6 -37.2 98 107 A K S S- 0 0 101 264,-0.0 207,-0.2 208,-0.0 2,-0.2 -0.998 70.3-144.4-133.7 124.6 -55.8 37.1 -33.9 99 108 A A E -d 305 0B 49 205,-2.3 207,-0.7 -2,-0.4 259,-0.1 -0.549 26.2-102.6 -91.0 156.5 -53.9 38.3 -30.9 100 109 A S E -d 306 0B 30 205,-0.2 202,-0.3 -2,-0.2 207,-0.1 -0.296 47.3 -89.1 -74.3 162.2 -54.6 37.2 -27.3 101 110 A G - 0 0 8 205,-0.9 -1,-0.1 239,-0.3 206,-0.0 -0.051 62.2 -62.4 -67.7 175.0 -56.5 39.5 -25.0 102 111 A P - 0 0 44 0, 0.0 -1,-0.2 0, 0.0 199,-0.1 -0.234 60.5-108.2 -57.6 142.0 -54.9 42.1 -22.7 103 112 A I - 0 0 67 -3,-0.1 2,-0.2 1,-0.1 238,-0.0 -0.253 30.3-120.5 -62.7 157.9 -52.5 40.8 -20.1 104 113 A L - 0 0 70 194,-0.1 -1,-0.1 193,-0.0 193,-0.1 -0.671 6.8-142.2 -95.1 156.1 -53.4 40.7 -16.4 105 114 A R - 0 0 114 -2,-0.2 3,-0.1 191,-0.1 193,-0.1 -0.771 26.2-141.9-118.5 85.6 -51.5 42.5 -13.7 106 115 A P - 0 0 103 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.066 31.0 -92.1 -46.5 140.8 -51.7 40.1 -10.7 107 116 A D - 0 0 146 1,-0.1 3,-0.1 188,-0.1 188,-0.0 -0.288 47.5-103.2 -57.0 139.5 -52.1 41.7 -7.3 108 117 A R - 0 0 55 -3,-0.1 32,-0.1 1,-0.1 -1,-0.1 -0.440 46.1 -95.0 -62.3 135.1 -48.8 42.4 -5.6 109 118 A P - 0 0 24 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 -0.258 36.3-135.2 -53.4 143.9 -48.1 39.9 -2.9 110 119 A Q S S+ 0 0 157 -3,-0.1 -2,-0.1 2,-0.1 3,-0.0 0.930 76.9 20.6 -77.8 -49.9 -49.3 41.4 0.4 111 120 A K S > S- 0 0 83 1,-0.1 3,-1.3 412,-0.0 4,-0.3 -0.810 91.8 -93.7-113.3 153.4 -46.6 40.7 2.9 112 121 A P T 3 S+ 0 0 0 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.397 112.6 30.0 -57.8 148.7 -42.9 39.8 2.2 113 122 A F T 3 S+ 0 0 2 2,-0.3 58,-2.5 57,-0.1 59,-0.3 0.421 87.3 106.7 77.0 -0.3 -42.3 36.1 2.1 114 123 A D S < S+ 0 0 23 -3,-1.3 58,-1.3 1,-0.3 2,-0.3 0.879 93.1 10.9 -68.1 -37.7 -45.8 35.5 0.8 115 124 A K E -e 172 0C 55 -4,-0.3 24,-3.7 56,-0.2 2,-0.4 -0.974 60.0-169.8-151.3 126.9 -44.2 34.7 -2.5 116 125 A F E -eF 173 138C 0 56,-2.6 58,-3.9 -2,-0.3 2,-0.4 -0.930 12.1-155.8-105.7 139.6 -40.8 34.1 -3.9 117 126 A F E -eF 174 137C 20 20,-2.8 20,-2.7 -2,-0.4 2,-0.3 -0.949 19.5-170.9-107.7 136.4 -40.2 34.0 -7.6 118 127 A I E + F 0 136C 1 56,-2.3 58,-0.5 -2,-0.4 2,-0.3 -0.932 14.3 152.2-132.1 156.7 -37.1 32.0 -8.7 119 128 A D E - 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0 0 34 -2,-2.5 4,-2.6 1,-0.1 5,-0.2 -0.783 68.2-118.3-123.4 150.9 -30.1 21.7 -11.0 154 163 A T H > S+ 0 0 24 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.920 113.3 53.1 -49.8 -52.7 -32.3 20.7 -8.1 155 164 A S H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.915 111.4 45.7 -54.8 -49.6 -29.4 19.8 -5.7 156 165 A A H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.932 113.0 51.0 -54.4 -49.8 -27.9 23.2 -6.3 157 166 A T H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.896 110.6 48.3 -59.3 -45.1 -31.2 25.0 -5.8 158 167 A V H X S+ 0 0 24 -4,-3.1 4,-2.6 2,-0.2 5,-0.2 0.967 109.0 53.6 -59.5 -52.3 -31.9 23.1 -2.6 159 168 A K H X S+ 0 0 156 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.906 113.7 42.5 -48.6 -47.8 -28.4 24.0 -1.2 160 169 A S H X S+ 0 0 13 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.929 113.7 50.1 -70.2 -44.9 -28.9 27.7 -1.9 161 170 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.764 102.9 61.4 -67.3 -25.5 -32.5 27.8 -0.6 162 171 A N H < S+ 0 0 45 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.944 108.3 43.8 -64.1 -44.9 -31.5 26.1 2.6 163 172 A V H >< S+ 0 0 80 -4,-1.4 3,-1.1 -5,-0.2 4,-0.4 0.965 116.7 47.2 -57.1 -54.0 -29.2 29.0 3.3 164 173 A L H >X S+ 0 0 1 -4,-2.5 3,-2.2 1,-0.3 2,-1.1 0.929 102.1 61.7 -57.2 -50.5 -31.8 31.5 2.3 165 174 A T T 3< S+ 0 0 5 -4,-3.0 -1,-0.3 1,-0.3 337,-0.1 0.054 84.0 80.7 -76.0 30.2 -34.7 30.0 4.3 166 175 A S T <4 S+ 0 0 10 -3,-1.1 -1,-0.3 -2,-1.1 -2,-0.2 0.717 91.7 49.6 -92.4 -34.7 -32.8 30.6 7.5 167 176 A I T <4 S- 0 0 23 -3,-2.2 2,-0.3 -4,-0.4 -2,-0.2 0.988 134.2 -32.0 -64.3 -56.1 -33.9 34.2 7.4 168 177 A A < - 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