==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-DEC-07 3BJ8 . COMPND 2 MOLECULE: DIAMINE ACETYLTRANSFERASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.J.MONTEMAYOR,D.W.HOFFMAN . 644 9 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33278.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 470 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 144 22.4 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 . 7 1.1 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 . 40 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.9 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 0 0 1 1 8 2 0 1 0 1 2 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 4 0 4 0 4 4 0 0 4 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 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 3 A K 0 0 104 0, 0.0 2,-0.3 0, 0.0 60,-0.1 0.000 360.0 360.0 360.0 -60.3 8.1 40.5 53.1 2 4 A F - 0 0 58 55,-0.2 2,-0.3 2,-0.0 55,-0.2 -0.935 360.0-152.5-143.7 167.8 7.1 40.1 49.4 3 5 A K E -A 56 0A 118 53,-1.9 53,-3.3 -2,-0.3 2,-0.6 -0.980 7.8-149.3-147.5 129.2 7.9 38.2 46.3 4 6 A I E +A 55 0A 17 -2,-0.3 51,-0.2 51,-0.2 68,-0.0 -0.881 30.8 156.2-101.5 123.2 7.6 39.1 42.6 5 7 A R E -A 54 0A 41 49,-1.6 49,-2.7 -2,-0.6 -2,-0.0 -0.938 48.0 -86.8-140.3 159.5 6.9 36.2 40.2 6 8 A P E -A 53 0A 90 0, 0.0 47,-0.2 0, 0.0 2,-0.0 -0.324 53.7-107.3 -64.5 153.7 5.3 35.7 36.8 7 9 A A - 0 0 12 45,-2.7 2,-0.3 3,-0.0 45,-0.1 -0.255 29.6-154.9 -78.1 168.6 1.6 35.3 36.8 8 10 A T > - 0 0 61 -2,-0.0 3,-1.4 1,-0.0 4,-0.5 -0.871 39.4 -94.6-135.8 168.4 -0.3 32.0 36.2 9 11 A A G > S+ 0 0 38 -2,-0.3 3,-0.8 1,-0.3 4,-0.3 0.790 124.6 63.1 -55.5 -25.6 -3.8 31.2 35.0 10 12 A S G > S+ 0 0 95 1,-0.2 3,-0.6 2,-0.1 -1,-0.3 0.803 96.5 54.6 -69.9 -32.5 -4.6 30.9 38.7 11 13 A D G X> S+ 0 0 11 -3,-1.4 4,-2.2 1,-0.2 3,-0.7 0.470 79.3 95.1 -81.4 -3.1 -3.8 34.6 39.4 12 14 A C H <> S+ 0 0 0 -3,-0.8 4,-2.5 -4,-0.5 -1,-0.2 0.864 79.5 57.3 -58.3 -34.4 -6.2 35.9 36.8 13 15 A S H <> S+ 0 0 57 -3,-0.6 4,-1.5 -4,-0.3 -1,-0.3 0.866 111.7 43.4 -62.4 -34.9 -8.9 36.4 39.4 14 16 A D H <> S+ 0 0 29 -3,-0.7 4,-2.0 -4,-0.2 -2,-0.2 0.793 109.2 55.7 -79.8 -33.0 -6.5 38.6 41.3 15 17 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.931 108.7 49.0 -65.7 -43.1 -5.3 40.5 38.2 16 18 A L H X S+ 0 0 20 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.936 108.6 53.3 -59.8 -47.2 -8.9 41.4 37.4 17 19 A R H X S+ 0 0 47 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.877 111.4 45.7 -55.4 -42.5 -9.5 42.6 41.0 18 20 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.875 108.7 55.7 -70.6 -37.3 -6.4 44.9 40.7 19 21 A I H X S+ 0 0 1 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.949 113.4 42.7 -58.5 -46.1 -7.6 46.1 37.3 20 22 A K H X S+ 0 0 86 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.841 109.3 54.9 -70.1 -34.7 -10.9 47.1 38.9 21 23 A E H X S+ 0 0 55 -4,-2.1 4,-0.6 -5,-0.2 -1,-0.2 0.828 110.5 48.5 -68.5 -29.9 -9.4 48.6 42.0 22 24 A L H >< S+ 0 0 47 -4,-1.8 3,-0.8 1,-0.2 4,-0.3 0.897 109.8 50.2 -74.2 -41.9 -7.3 50.8 39.8 23 25 A A H ><>S+ 0 0 1 -4,-1.8 5,-2.1 1,-0.2 3,-1.9 0.779 97.3 72.2 -66.3 -27.0 -10.3 51.8 37.7 24 26 A K H ><5S+ 0 0 103 -4,-1.6 3,-3.1 1,-0.3 -1,-0.2 0.862 83.1 67.6 -56.7 -38.1 -12.1 52.7 40.9 25 27 A Y T <<5S+ 0 0 112 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.731 108.6 39.0 -56.2 -20.5 -10.0 55.7 41.4 26 28 A E T < 5S- 0 0 96 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.149 114.8-118.7-112.5 14.3 -11.8 57.1 38.3 27 29 A Y T < 5S+ 0 0 186 -3,-3.1 -3,-0.2 1,-0.1 -2,-0.1 0.835 85.6 113.9 49.7 37.6 -15.1 55.6 39.4 28 30 A M > < + 0 0 62 -5,-2.1 3,-2.3 -8,-0.1 4,-0.3 -0.070 17.0 128.5-126.8 33.2 -15.1 53.5 36.2 29 31 A E T 3 S+ 0 0 87 1,-0.3 3,-0.1 -6,-0.2 -5,-0.1 0.478 72.6 64.9 -68.0 1.4 -14.8 50.0 37.6 30 32 A D T 3 S+ 0 0 114 1,-0.2 -1,-0.3 -7,-0.1 -2,-0.1 0.481 81.7 75.1-100.2 -5.3 -17.8 49.3 35.3 31 33 A Q S < S+ 0 0 79 -3,-2.3 2,-1.1 -11,-0.1 -2,-0.2 0.620 73.3 98.3 -78.2 -14.4 -15.8 50.0 32.2 32 34 A V + 0 0 14 -4,-0.3 216,-0.1 1,-0.2 215,-0.1 -0.643 39.2 163.5 -78.6 97.7 -14.1 46.6 32.8 33 35 A I + 0 0 119 214,-1.2 -1,-0.2 -2,-1.1 2,-0.2 0.524 45.7 106.2 -91.2 -5.8 -16.0 44.2 30.5 34 36 A L - 0 0 10 213,-1.1 2,-0.3 212,-0.2 215,-0.1 -0.472 53.6-163.4 -74.9 144.4 -13.2 41.7 30.9 35 37 A T > - 0 0 65 -2,-0.2 4,-1.9 1,-0.1 3,-0.4 -0.757 38.5 -97.7-121.8 168.9 -13.8 38.6 33.0 36 38 A E H > S+ 0 0 72 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.858 123.7 59.8 -54.3 -35.9 -11.5 36.1 34.6 37 39 A K H > S+ 0 0 134 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.936 104.9 47.6 -57.8 -49.2 -12.2 33.8 31.6 38 40 A D H > S+ 0 0 49 -3,-0.4 4,-3.7 1,-0.2 5,-0.4 0.941 110.6 50.0 -58.4 -52.1 -10.8 36.4 29.2 39 41 A L H X S+ 0 0 1 -4,-1.9 4,-1.9 1,-0.2 5,-0.3 0.873 112.8 48.5 -57.2 -38.4 -7.6 37.0 31.1 40 42 A Q H X S+ 0 0 54 -4,-2.1 4,-3.0 -5,-0.2 -1,-0.2 0.940 117.4 39.2 -68.4 -47.7 -7.0 33.3 31.4 41 43 A E H X S+ 0 0 124 -4,-2.6 4,-0.8 2,-0.2 6,-0.3 0.932 120.5 44.7 -67.5 -46.7 -7.6 32.6 27.7 42 44 A D H < S+ 0 0 10 -4,-3.7 7,-3.0 -5,-0.2 8,-0.4 0.824 125.8 33.1 -67.0 -31.2 -5.9 35.8 26.5 43 45 A G H < S+ 0 0 7 -4,-1.9 -2,-0.2 -5,-0.4 -3,-0.2 0.780 130.2 26.6 -98.6 -29.5 -3.0 35.2 28.8 44 46 A F H < S+ 0 0 86 -4,-3.0 -2,-0.2 -5,-0.3 -3,-0.2 0.017 95.5 100.5-126.2 31.6 -2.5 31.5 29.1 45 47 A G S < S- 0 0 40 -4,-0.8 -3,-0.1 2,-0.3 -4,-0.0 -0.106 99.5 -68.3 -94.7-161.9 -3.9 30.1 25.9 46 48 A E S S+ 0 0 195 1,-0.2 -4,-0.1 -2,-0.1 -5,-0.0 0.741 128.8 37.3 -64.3 -21.3 -1.9 29.0 22.8 47 49 A H S S- 0 0 83 -6,-0.3 2,-0.5 0, 0.0 -2,-0.3 -0.920 79.8-142.0-137.2 112.3 -0.9 32.6 22.3 48 50 A P - 0 0 50 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.585 13.2-174.7 -75.1 120.7 -0.2 35.1 25.1 49 51 A F S S+ 0 0 33 -7,-3.0 2,-0.3 -2,-0.5 -6,-0.2 0.419 73.8 8.0 -92.0 -0.9 -1.6 38.5 24.3 50 52 A Y - 0 0 3 -8,-0.4 2,-0.3 -7,-0.1 26,-0.2 -0.965 66.5-137.5-165.5 170.4 -0.1 40.0 27.5 51 53 A H E - B 0 75A 61 24,-1.9 24,-2.8 -2,-0.3 2,-0.4 -0.991 17.3-160.4-139.6 144.0 2.3 39.1 30.3 52 54 A C E - B 0 74A 8 -2,-0.3 -45,-2.7 22,-0.2 2,-0.4 -0.979 12.7-161.2-134.1 143.6 2.0 39.8 34.0 53 55 A L E -AB 6 73A 7 20,-1.9 20,-1.6 -2,-0.4 2,-0.3 -0.957 21.3-158.9-115.1 133.8 4.2 40.0 37.0 54 56 A V E -AB 5 72A 0 -49,-2.7 -49,-1.6 -2,-0.4 2,-0.6 -0.842 14.9-133.0-115.5 155.8 2.5 39.8 40.4 55 57 A A E -AB 4 71A 0 16,-2.7 15,-2.3 -2,-0.3 16,-0.6 -0.937 26.8-167.6-107.5 118.4 3.5 40.9 43.9 56 58 A E E -AB 3 69A 57 -53,-3.3 -53,-1.9 -2,-0.6 13,-0.2 -0.924 4.9-167.1-115.0 128.5 2.9 38.1 46.5 57 59 A V - 0 0 4 11,-2.7 -55,-0.2 -2,-0.5 -2,-0.0 -0.824 29.0-101.5-110.6 150.6 3.0 38.6 50.2 58 60 A P > - 0 0 60 0, 0.0 3,-2.9 0, 0.0 -1,-0.1 -0.209 41.7 -97.0 -65.5 159.6 3.1 35.9 52.9 59 61 A K G > S+ 0 0 155 1,-0.3 3,-1.5 2,-0.2 7,-0.0 0.791 122.8 67.0 -46.4 -34.5 -0.1 34.9 54.9 60 62 A E G 3 S+ 0 0 161 1,-0.3 -1,-0.3 -59,-0.0 -3,-0.0 0.783 109.3 37.1 -59.8 -26.9 1.1 37.2 57.7 61 63 A H G < S+ 0 0 58 -3,-2.9 -1,-0.3 -60,-0.1 -2,-0.2 0.032 84.1 134.9-116.4 26.1 0.6 40.2 55.3 62 64 A W < - 0 0 108 -3,-1.5 6,-0.2 1,-0.1 -3,-0.0 -0.114 58.7 -99.5 -64.7 173.7 -2.5 39.2 53.4 63 65 A T > - 0 0 10 4,-1.4 3,-2.5 1,-0.1 -1,-0.1 -0.431 36.6 -93.9 -92.7 170.6 -5.3 41.8 52.9 64 66 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.837 130.4 47.1 -50.6 -37.3 -8.5 42.2 54.9 65 67 A E T 3 S- 0 0 123 2,-0.1 -3,-0.0 0, 0.0 0, 0.0 0.455 125.5-105.5 -85.3 -1.2 -10.3 40.0 52.4 66 68 A G < + 0 0 37 -3,-2.5 2,-0.4 1,-0.2 -4,-0.1 0.878 64.9 151.4 82.6 40.9 -7.5 37.5 52.5 67 69 A H - 0 0 55 1,-0.1 -4,-1.4 -6,-0.1 -1,-0.2 -0.838 33.9-164.2-106.4 143.7 -5.6 38.1 49.2 68 70 A S S S+ 0 0 30 -2,-0.4 -11,-2.7 -6,-0.2 2,-0.7 0.576 70.8 84.3 -97.4 -13.8 -1.9 37.4 48.8 69 71 A I E +B 56 0A 1 -13,-0.2 -13,-0.2 1,-0.1 3,-0.1 -0.817 44.5 163.8 -95.9 112.0 -1.5 39.4 45.5 70 72 A V E + 0 0 0 -15,-2.3 25,-2.9 -2,-0.7 2,-0.3 0.303 60.0 6.6-111.0 9.5 -1.0 43.1 46.2 71 73 A G E -BC 55 94A 0 -16,-0.6 -16,-2.7 23,-0.3 2,-0.3 -0.946 54.9-176.2 179.7 159.9 0.3 44.4 42.9 72 74 A F E -BC 54 93A 0 21,-2.6 21,-2.2 -2,-0.3 2,-0.4 -0.967 17.7-142.1-158.3 172.7 1.1 43.7 39.2 73 75 A A E -BC 53 92A 0 -20,-1.6 -20,-1.9 -2,-0.3 2,-0.5 -0.988 15.1-158.6-142.7 132.4 2.5 44.9 35.9 74 76 A M E +BC 52 91A 0 17,-2.7 16,-1.9 -2,-0.4 17,-1.7 -0.968 24.9 158.4-115.9 129.5 0.9 44.0 32.6 75 77 A Y E -BC 51 89A 19 -24,-2.8 -24,-1.9 -2,-0.5 2,-0.3 -0.915 19.9-177.9-145.5 170.6 3.1 44.2 29.5 76 78 A Y E - C 0 88A 16 12,-1.8 12,-2.6 -2,-0.3 2,-0.3 -0.960 35.9 -95.5-163.6 157.3 3.6 43.1 25.9 77 79 A F E - C 0 87A 40 -2,-0.3 2,-0.2 10,-0.2 10,-0.2 -0.631 39.2-179.3 -86.5 135.7 6.1 43.6 23.1 78 80 A T E - C 0 86A 7 8,-2.3 8,-2.5 -2,-0.3 2,-0.4 -0.670 16.5-131.8-121.4 178.4 5.6 46.3 20.5 79 81 A Y E - C 0 85A 2 6,-0.2 6,-0.2 -2,-0.2 162,-0.0 -0.999 6.8-160.6-140.7 138.8 7.6 47.4 17.5 80 82 A D E > - C 0 84A 45 4,-1.5 4,-2.8 -2,-0.4 3,-0.2 -0.976 18.7-142.2-116.1 124.2 8.7 50.7 16.1 81 83 A P T 4 S+ 0 0 3 0, 0.0 118,-0.3 0, 0.0 -1,-0.1 0.678 99.2 49.9 -61.0 -15.7 9.7 50.8 12.4 82 84 A W T 4 S+ 0 0 55 2,-0.1 116,-2.3 115,-0.1 117,-1.2 0.854 130.1 9.0 -90.8 -37.5 12.6 53.1 13.1 83 85 A I T 4 S- 0 0 51 1,-0.3 2,-0.2 -3,-0.2 38,-0.1 0.567 97.8-125.3-121.9 -13.4 14.3 51.4 16.0 84 86 A G E < +C 80 0A 2 -4,-2.8 -4,-1.5 115,-0.1 -1,-0.3 -0.635 58.3 14.4 108.3-163.3 12.8 47.9 16.5 85 87 A K E -C 79 0A 39 -2,-0.2 36,-1.8 -6,-0.2 37,-0.4 -0.246 57.1-175.2 -63.0 136.5 11.3 45.9 19.3 86 88 A L E -C 78 0A 6 -8,-2.5 -8,-2.3 34,-0.2 2,-0.6 -0.892 27.2-125.2-127.3 156.0 10.2 47.6 22.5 87 89 A L E -Cd 77 123A 0 35,-2.7 37,-1.9 -2,-0.3 2,-0.7 -0.922 29.3-155.5-102.2 120.9 8.8 46.3 25.8 88 90 A Y E -Cd 76 124A 41 -12,-2.6 -12,-1.8 -2,-0.6 2,-0.9 -0.870 6.1-152.6-106.0 116.1 5.5 48.1 26.4 89 91 A L E +C 75 0A 7 35,-2.9 37,-0.5 -2,-0.7 -14,-0.2 -0.755 17.9 176.0 -87.3 105.6 4.3 48.4 30.0 90 92 A E E + 0 0 48 -16,-1.9 2,-0.3 -2,-0.9 -15,-0.2 0.901 63.7 8.5 -76.3 -48.4 0.5 48.7 29.8 91 93 A D E +C 74 0A 29 -17,-1.7 -17,-2.7 34,-0.0 2,-0.3 -0.990 55.2 178.0-139.3 149.4 -0.4 48.7 33.5 92 94 A F E +C 73 0A 45 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.2 -0.882 18.7 154.7-153.5 112.3 1.4 49.0 36.7 93 95 A F E -C 72 0A 14 -21,-2.2 -21,-2.6 -2,-0.3 2,-0.4 -0.999 22.3-170.2-146.7 146.7 -0.3 49.1 40.1 94 96 A V E -C 71 0A 14 -2,-0.3 -23,-0.3 -23,-0.2 5,-0.2 -0.992 41.2-102.0-136.4 124.5 0.3 48.3 43.8 95 97 A M > - 0 0 15 -25,-2.9 3,-2.1 -2,-0.4 4,-0.4 -0.153 35.1-119.3 -46.8 133.6 -2.4 48.2 46.4 96 98 A S G > S+ 0 0 59 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.834 111.2 54.0 -44.6 -49.8 -2.3 51.4 48.5 97 99 A D G 3 S+ 0 0 129 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.716 112.2 49.4 -62.4 -18.0 -1.6 49.8 51.8 98 100 A Y G X S+ 0 0 21 -3,-2.1 3,-0.6 -28,-0.2 5,-0.4 0.431 85.5 98.9-105.7 1.8 1.3 48.0 50.2 99 101 A R T < + 0 0 104 -3,-1.3 -28,-0.0 -4,-0.4 -4,-0.0 -0.584 65.5 49.8 -89.0 152.7 3.3 50.8 48.4 100 102 A G T 3 S+ 0 0 80 -2,-0.2 -1,-0.2 0, 0.0 -2,-0.0 0.246 87.1 86.2 108.4 -11.7 6.3 52.4 50.0 101 103 A F S < S- 0 0 121 -3,-0.6 -2,-0.1 -100,-0.0 -3,-0.0 0.596 110.1 -93.0 -95.6 -15.4 8.1 49.1 50.8 102 104 A G S > S+ 0 0 27 -4,-0.1 4,-1.5 3,-0.0 5,-0.1 0.571 85.0 127.0 113.8 13.3 9.8 48.6 47.5 103 105 A I H > S+ 0 0 1 -5,-0.4 4,-2.2 2,-0.2 5,-0.2 0.939 77.4 47.5 -67.1 -47.2 7.4 46.3 45.6 104 106 A G H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.940 110.7 51.7 -58.9 -48.1 7.2 48.6 42.6 105 107 A S H > S+ 0 0 49 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.848 109.6 51.0 -58.1 -34.6 10.9 48.9 42.4 106 108 A E H X S+ 0 0 68 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.887 108.9 50.6 -69.4 -39.5 11.2 45.1 42.5 107 109 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.866 109.7 51.3 -65.4 -35.6 8.6 44.8 39.7 108 110 A L H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.815 105.5 54.9 -72.5 -29.2 10.7 47.3 37.6 109 111 A K H X S+ 0 0 69 -4,-1.3 4,-1.6 -5,-0.2 -1,-0.2 0.886 111.8 44.9 -69.7 -37.7 13.8 45.3 38.2 110 112 A N H X S+ 0 0 29 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.942 111.7 50.1 -70.7 -49.8 12.0 42.2 36.8 111 113 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.885 110.7 53.0 -55.1 -38.0 10.5 44.1 33.8 112 114 A S H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.905 106.9 50.8 -64.2 -40.0 14.1 45.3 33.2 113 115 A Q H X S+ 0 0 86 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.848 111.0 48.8 -66.0 -33.2 15.3 41.7 33.2 114 116 A V H X S+ 0 0 31 -4,-2.2 4,-3.2 2,-0.2 5,-0.3 0.907 109.4 52.6 -71.2 -42.2 12.6 40.8 30.7 115 117 A A H X>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 4,-1.1 0.874 110.9 46.5 -61.3 -38.7 13.6 43.8 28.5 116 118 A M H <5S+ 0 0 25 -4,-2.1 -1,-0.2 3,-0.2 -2,-0.2 0.881 112.9 50.0 -72.4 -35.5 17.2 42.7 28.6 117 119 A K H <5S+ 0 0 183 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.933 112.7 45.0 -66.1 -46.6 16.2 39.1 27.8 118 120 A a H <5S- 0 0 20 -4,-3.2 -1,-0.2 -5,-0.1 -2,-0.2 0.777 108.4-131.3 -64.2 -25.5 14.0 40.2 24.9 119 121 A R T <5 + 0 0 100 -4,-1.1 2,-0.2 -5,-0.3 -3,-0.2 0.828 44.5 173.5 71.1 34.1 16.9 42.4 24.0 120 122 A a < - 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