==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/ANTIBIOTIC 16-JUN-11 3SH8 . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS; . AUTHOR W.-T.WONG,Y.-X.ZHAO,Y.-C.LEUNG . 505 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22059.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 345 68.3 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 . 72 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 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 . 11 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.0 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 2 5 6 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 4 0 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 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 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 30 A K > 0 0 72 0, 0.0 4,-1.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 151.5 -15.1 -33.3 -24.1 2 31 A D H > + 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.736 360.0 65.4 -70.9 -23.4 -18.9 -32.6 -23.8 3 32 A D H > S+ 0 0 76 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.893 102.6 45.9 -62.5 -42.3 -18.2 -32.2 -20.0 4 33 A F H > S+ 0 0 3 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.852 112.5 51.4 -66.4 -36.7 -16.1 -29.1 -20.8 5 34 A A H X S+ 0 0 38 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.863 107.5 53.2 -66.5 -37.1 -18.9 -27.9 -23.1 6 35 A K H X S+ 0 0 95 -4,-2.4 4,-3.5 2,-0.2 -2,-0.2 0.890 107.5 50.9 -64.1 -40.6 -21.3 -28.4 -20.3 7 36 A L H X S+ 0 0 10 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.871 108.4 51.0 -65.6 -39.0 -19.2 -26.2 -18.0 8 37 A E H X>S+ 0 0 24 -4,-1.7 5,-1.6 2,-0.2 4,-0.7 0.870 114.5 45.7 -62.1 -38.8 -19.1 -23.5 -20.6 9 38 A E H ><5S+ 0 0 154 -4,-1.7 3,-0.7 3,-0.2 -2,-0.2 0.963 114.7 46.5 -64.6 -56.0 -22.9 -23.8 -20.8 10 39 A Q H 3<5S+ 0 0 137 -4,-3.5 -2,-0.2 1,-0.2 -3,-0.2 0.810 122.8 33.5 -57.7 -38.5 -23.3 -23.9 -17.0 11 40 A F H 3<5S- 0 0 42 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.382 100.4-124.4-105.4 2.8 -21.0 -20.9 -16.3 12 41 A D T <<5S+ 0 0 79 -3,-0.7 219,-0.4 -4,-0.7 2,-0.3 0.955 72.4 116.3 50.4 55.4 -21.7 -18.8 -19.4 13 42 A A < - 0 0 15 -5,-1.6 2,-0.5 -6,-0.2 217,-0.2 -0.908 69.3-113.3-144.4 167.4 -17.9 -18.8 -20.1 14 43 A K E -A 229 0A 67 215,-3.1 215,-1.7 -2,-0.3 2,-0.4 -0.942 33.8-151.7-106.3 132.9 -15.2 -19.8 -22.6 15 44 A L E -A 228 0A 0 -2,-0.5 2,-0.4 213,-0.2 213,-0.2 -0.835 11.3-165.9-110.0 140.1 -12.8 -22.5 -21.3 16 45 A G E +A 227 0A 0 211,-3.0 211,-3.2 -2,-0.4 2,-0.4 -0.982 19.1 179.7-126.4 118.2 -9.2 -23.1 -22.3 17 46 A I E +AB 226 30A 0 13,-3.3 13,-2.1 -2,-0.4 2,-0.3 -0.969 17.2 157.4-130.9 124.5 -7.7 -26.4 -21.2 18 47 A F E +AB 225 29A 13 207,-1.9 207,-2.4 -2,-0.4 2,-0.4 -0.932 9.4 170.3-142.6 126.5 -4.4 -28.2 -21.5 19 48 A A E -AB 224 28A 0 9,-2.3 9,-2.2 -2,-0.3 2,-0.4 -0.990 9.8-168.6-131.0 140.0 -3.1 -30.9 -19.2 20 49 A L E -AB 223 27A 20 203,-2.5 203,-2.4 -2,-0.4 2,-0.7 -0.974 15.8-149.5-132.5 117.6 -0.1 -33.2 -19.6 21 50 A D E > -A 222 0A 28 5,-2.3 4,-2.1 -2,-0.4 3,-0.5 -0.788 13.9-157.5 -77.0 113.6 0.7 -36.3 -17.6 22 51 A T T 4 S+ 0 0 23 199,-2.2 -1,-0.1 -2,-0.7 200,-0.1 0.584 86.5 56.9 -74.5 -10.4 4.5 -36.2 -17.7 23 52 A G T 4 S+ 0 0 39 197,-0.3 -1,-0.2 198,-0.2 199,-0.1 0.773 124.2 16.6 -87.6 -30.4 4.7 -39.9 -17.0 24 53 A T T 4 S- 0 0 59 -3,-0.5 -2,-0.2 2,-0.2 3,-0.1 0.501 91.6-126.7-120.2 -11.1 2.6 -41.2 -19.9 25 54 A N < + 0 0 113 -4,-2.1 2,-0.2 1,-0.3 -3,-0.1 0.581 57.2 153.2 63.1 13.7 2.5 -38.2 -22.3 26 55 A R - 0 0 146 -5,-0.3 -5,-2.3 227,-0.1 2,-0.4 -0.499 28.6-152.9 -73.0 144.4 -1.3 -38.5 -22.2 27 56 A T E -B 20 0A 74 -7,-0.2 2,-0.4 -2,-0.2 -7,-0.2 -0.898 21.6-161.4-127.8 141.9 -3.0 -35.3 -22.9 28 57 A V E +B 19 0A 15 -9,-2.2 -9,-2.3 -2,-0.4 2,-0.3 -0.991 24.2 174.2-120.8 136.2 -6.3 -33.5 -22.2 29 59 A A E +B 18 0A 42 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.982 21.9 162.8-149.8 126.0 -7.3 -30.5 -24.3 30 60 A Y E S-B 17 0A 36 -13,-2.1 -13,-3.3 -2,-0.3 118,-0.1 -0.910 90.0 -20.2-143.0 116.9 -10.2 -28.1 -24.9 31 61 A R S > S+ 0 0 99 -2,-0.3 3,-1.5 -15,-0.2 117,-0.4 0.887 84.3 162.9 47.4 46.2 -9.5 -24.9 -26.8 32 62 A P T 3 + 0 0 23 0, 0.0 117,-2.3 0, 0.0 118,-0.4 0.713 69.9 42.8 -69.5 -20.6 -5.8 -25.5 -25.9 33 63 A D T 3 S+ 0 0 99 115,-0.2 2,-0.3 114,-0.1 -2,-0.1 0.186 87.6 114.9-110.6 11.5 -4.5 -23.1 -28.6 34 64 A E < - 0 0 76 -3,-1.5 114,-0.5 -4,-0.1 2,-0.3 -0.673 68.6-117.9 -81.7 136.6 -7.1 -20.3 -28.0 35 65 A R + 0 0 87 -2,-0.3 2,-0.3 112,-0.1 112,-0.2 -0.580 37.0 168.8 -82.6 134.9 -5.7 -17.1 -26.6 36 66 A F E -E 146 0B 7 110,-2.5 110,-2.2 -2,-0.3 2,-0.3 -0.946 47.0 -91.5-132.4 155.1 -6.7 -15.7 -23.2 37 67 A A E -E 145 0B 25 -2,-0.3 108,-0.3 108,-0.2 191,-0.2 -0.554 33.7-148.5 -63.1 126.4 -5.2 -12.8 -21.1 38 68 A F > + 0 0 2 106,-1.7 3,-1.7 -2,-0.3 -1,-0.2 0.764 29.1 175.6 -71.8 -23.1 -2.6 -14.6 -18.9 39 69 A A G > - 0 0 0 105,-0.5 3,-1.4 97,-0.4 -1,-0.2 -0.210 66.2 -11.4 49.2-137.4 -3.2 -12.1 -16.0 40 70 A S G > S+ 0 0 8 1,-0.3 3,-1.8 162,-0.2 4,-0.4 0.557 115.7 86.9 -73.2 -7.1 -1.2 -13.0 -12.9 41 71 A T G X> S+ 0 0 0 -3,-1.7 3,-1.2 1,-0.3 4,-0.8 0.810 78.1 70.3 -58.1 -26.9 -0.2 -16.5 -14.2 42 72 A I H <> S+ 0 0 4 -3,-1.4 4,-2.2 1,-0.2 -1,-0.3 0.731 80.5 73.9 -61.4 -24.7 2.7 -14.6 -15.8 43 73 A K H <> S+ 0 0 1 -3,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.843 92.8 54.6 -58.4 -35.6 4.3 -14.0 -12.3 44 74 A A H <> S+ 0 0 2 -3,-1.2 4,-1.7 -4,-0.4 -1,-0.2 0.932 111.2 42.7 -62.8 -48.1 5.3 -17.7 -12.2 45 75 A L H X S+ 0 0 1 -4,-0.8 4,-1.9 2,-0.2 -2,-0.2 0.807 110.3 58.7 -69.3 -30.3 7.2 -17.4 -15.5 46 76 A T H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.928 106.9 45.3 -65.2 -47.6 8.7 -14.1 -14.4 47 77 A V H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.876 107.7 60.3 -61.6 -38.1 10.3 -15.6 -11.3 48 78 A G H X S+ 0 0 0 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.938 109.3 42.2 -50.5 -50.0 11.4 -18.5 -13.6 49 79 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.904 112.7 53.2 -65.9 -43.8 13.4 -15.9 -15.6 50 80 A L H X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.918 109.2 49.2 -56.5 -47.2 14.6 -14.1 -12.5 51 81 A L H < S+ 0 0 1 -4,-3.1 -1,-0.2 2,-0.2 -2,-0.2 0.858 110.0 51.2 -60.5 -37.7 16.0 -17.4 -11.1 52 82 A Q H < S+ 0 0 68 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.916 113.5 45.1 -68.9 -31.7 17.7 -18.1 -14.4 53 83 A Q H < S+ 0 0 78 -4,-2.2 2,-0.3 -5,-0.1 -2,-0.2 0.753 113.5 52.6 -83.1 -25.0 19.3 -14.5 -14.3 54 86 A K S < S- 0 0 38 -4,-1.6 2,-0.1 -5,-0.1 5,-0.0 -0.862 74.1-126.4-127.3 140.8 20.5 -14.5 -10.4 55 87 A S > - 0 0 51 -2,-0.3 4,-0.8 1,-0.1 -2,-0.0 -0.364 41.3-106.2 -67.5 164.7 22.5 -16.8 -8.2 56 88 A I T >4 S+ 0 0 54 1,-0.2 3,-1.0 2,-0.2 4,-0.3 0.914 124.2 52.9 -62.8 -39.6 20.6 -17.8 -5.0 57 89 A E G >4 S+ 0 0 135 1,-0.2 3,-2.0 2,-0.2 -1,-0.2 0.885 100.2 62.2 -60.4 -39.1 22.9 -15.4 -3.0 58 90 A D G >4 S+ 0 0 83 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 0.736 88.8 71.5 -56.7 -25.6 22.0 -12.6 -5.5 59 91 A L G << S+ 0 0 0 -3,-1.0 29,-2.6 -4,-0.8 28,-0.4 0.653 83.9 69.4 -67.6 -15.2 18.4 -12.9 -4.4 60 92 A N G < + 0 0 74 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.493 69.8 123.2 -81.2 -4.2 19.4 -11.3 -1.1 61 93 A Q < - 0 0 88 -3,-1.7 26,-1.7 -4,-0.1 2,-0.4 -0.394 66.5-124.3 -55.9 127.7 20.0 -8.0 -2.9 62 94 A R E -F 86 0C 130 24,-0.2 2,-0.5 -2,-0.1 24,-0.3 -0.664 20.3-154.3 -81.0 128.3 17.8 -5.4 -1.2 63 95 A I E -F 85 0C 13 22,-3.2 22,-2.4 -2,-0.4 2,-0.4 -0.919 4.2-155.3-102.7 124.7 15.4 -3.5 -3.5 64 96 A T + 0 0 120 -2,-0.5 2,-0.3 20,-0.2 17,-0.1 -0.814 20.8 170.8 -94.6 141.4 14.3 -0.0 -2.4 65 97 A Y - 0 0 12 16,-0.4 2,-0.2 -2,-0.4 19,-0.1 -0.957 22.4-129.3-146.8 163.8 11.1 1.3 -3.8 66 98 A T > - 0 0 80 -2,-0.3 3,-1.8 1,-0.1 4,-0.4 -0.617 36.1-100.2-111.1 168.7 8.7 4.2 -3.3 67 99 A R G > S+ 0 0 169 1,-0.3 3,-0.8 -2,-0.2 -1,-0.1 0.716 121.2 68.3 -56.3 -22.3 4.9 4.6 -2.7 68 100 A D G 3 S+ 0 0 149 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.743 90.2 59.7 -69.5 -26.6 4.9 5.3 -6.5 69 101 A D G < S+ 0 0 57 -3,-1.8 2,-0.2 2,-0.0 -1,-0.2 0.584 87.2 100.0 -76.6 -11.9 5.8 1.7 -7.2 70 102 A L < + 0 0 25 -3,-0.8 2,-0.1 -4,-0.4 4,-0.1 -0.565 50.7 170.8 -77.4 138.8 2.6 0.7 -5.4 71 103 A V - 0 0 56 -2,-0.2 3,-0.2 2,-0.1 -1,-0.1 -0.066 51.4 -45.0-122.0-139.3 -0.4 -0.2 -7.6 72 104 A N S S+ 0 0 128 1,-0.2 2,-0.3 -2,-0.1 -2,-0.1 0.777 124.9 24.0 -74.4 -30.0 -3.9 -1.7 -7.3 73 105 A Y + 0 0 107 25,-0.0 27,-2.0 1,-0.0 28,-0.7 -0.897 60.6 153.4-145.8 108.9 -3.0 -4.7 -5.0 74 106 A N > + 0 0 18 -2,-0.3 4,-2.2 -3,-0.2 5,-0.2 -0.421 5.5 161.5-134.8 56.4 0.1 -4.6 -2.8 75 107 A P T 4 S+ 0 0 8 0, 0.0 -1,-0.1 0, 0.0 23,-0.0 0.773 84.4 18.6 -57.3 -33.5 -0.6 -6.9 0.2 76 108 A I T >4 S+ 0 0 17 2,-0.1 3,-1.5 17,-0.1 4,-0.2 0.829 121.6 57.3-102.3 -46.5 3.1 -7.3 1.2 77 109 A T G >4 S+ 0 0 0 1,-0.3 3,-1.5 2,-0.2 7,-0.1 0.778 96.8 63.6 -57.6 -35.0 4.9 -4.4 -0.5 78 110 A E G 3< S+ 0 0 97 -4,-2.2 3,-0.4 1,-0.2 -1,-0.3 0.728 100.1 56.1 -63.1 -20.9 2.7 -1.8 1.2 79 111 A K G < S+ 0 0 49 -3,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.464 110.1 42.4 -90.6 -3.6 4.2 -2.9 4.5 80 112 A H <> + 0 0 28 -3,-1.5 4,-2.2 -4,-0.2 -15,-0.2 0.057 63.1 121.2-138.2 29.9 7.8 -2.3 3.6 81 113 A V T 4 S+ 0 0 46 -3,-0.4 -16,-0.4 1,-0.2 -1,-0.1 0.860 83.7 47.5 -61.0 -35.1 8.3 1.0 1.7 82 114 A D T 4 S+ 0 0 105 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.905 122.8 29.3 -75.1 -44.3 10.7 2.3 4.3 83 115 A T T 4 S- 0 0 66 1,-0.2 -2,-0.2 -19,-0.0 -1,-0.2 0.694 99.4-144.5 -89.1 -22.5 13.0 -0.8 4.7 84 116 A G < - 0 0 1 -4,-2.2 2,-0.3 -7,-0.1 -20,-0.2 -0.291 16.0-100.1 78.3-174.4 12.6 -2.1 1.1 85 117 A M E -F 63 0C 3 -22,-2.4 -22,-3.2 -4,-0.1 2,-0.1 -0.994 22.6-114.0-145.4 147.4 12.5 -5.8 0.3 86 118 A T E > -F 62 0C 13 -2,-0.3 4,-2.5 -24,-0.3 -24,-0.2 -0.397 33.4-111.2 -75.2 158.7 15.0 -8.4 -1.0 87 119 A L H > S+ 0 0 0 -26,-1.7 4,-2.4 -28,-0.4 -27,-0.2 0.882 121.6 53.9 -54.6 -39.6 14.5 -10.0 -4.5 88 120 A K H > S+ 0 0 65 -29,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.922 109.3 46.8 -61.1 -46.8 13.8 -13.3 -2.6 89 121 A E H > S+ 0 0 64 -30,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.864 111.5 52.1 -62.2 -38.4 11.1 -11.6 -0.5 90 122 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.893 108.3 50.3 -66.2 -40.7 9.6 -10.0 -3.6 91 123 A A H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.907 111.1 49.6 -61.5 -44.3 9.5 -13.4 -5.3 92 124 A D H X S+ 0 0 39 -4,-2.1 4,-2.5 2,-0.2 5,-0.4 0.922 113.3 46.0 -58.8 -47.6 7.7 -14.8 -2.3 93 125 A A H X S+ 0 0 0 -4,-2.4 6,-1.7 1,-0.2 4,-1.2 0.889 114.6 48.1 -63.8 -42.1 5.2 -11.9 -2.2 94 126 A S H X S+ 0 0 0 -4,-2.7 4,-0.9 4,-0.2 -2,-0.2 0.932 120.0 35.1 -64.4 -48.1 4.6 -12.1 -6.0 95 127 A L H < S+ 0 0 0 -4,-2.7 105,-0.2 -5,-0.2 -2,-0.2 0.894 124.8 36.3 -79.4 -41.5 4.0 -15.9 -6.1 96 128 A R H < S+ 0 0 21 -4,-2.5 84,-2.1 -5,-0.3 85,-0.2 0.662 134.8 21.2 -90.3 -18.2 2.3 -16.6 -2.8 97 129 A Y H < S- 0 0 35 -4,-1.2 -3,-0.2 -5,-0.4 -2,-0.2 0.465 95.6-123.0-124.2 -9.0 0.1 -13.5 -2.6 98 130 A S < - 0 0 13 -4,-0.9 2,-0.6 -5,-0.3 -4,-0.2 0.894 38.6-172.3 58.6 42.6 -0.0 -12.2 -6.2 99 131 A D > - 0 0 0 -6,-1.7 4,-1.7 1,-0.2 -1,-0.2 -0.571 12.2-159.5 -67.9 112.9 1.5 -8.9 -5.1 100 132 A N H > S+ 0 0 11 -27,-2.0 4,-2.0 -2,-0.6 -26,-0.2 0.855 88.4 50.8 -67.7 -38.9 1.3 -6.7 -8.2 101 133 A A H > S+ 0 0 0 -28,-0.7 4,-2.6 2,-0.2 -1,-0.2 0.875 107.8 54.6 -66.4 -38.8 3.9 -4.2 -7.1 102 134 A A H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.915 108.0 49.3 -58.6 -46.1 6.3 -7.1 -6.3 103 135 A Q H X S+ 0 0 4 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.913 111.6 49.0 -58.7 -45.5 5.9 -8.4 -9.9 104 136 A N H X S+ 0 0 19 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.906 111.2 49.9 -61.6 -43.9 6.5 -4.9 -11.3 105 137 A L H X S+ 0 0 7 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.883 113.9 45.0 -59.6 -44.0 9.6 -4.6 -9.1 106 138 A I H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.915 110.7 53.7 -66.9 -43.5 10.9 -8.0 -10.3 107 139 A L H X>S+ 0 0 6 -4,-3.0 5,-3.4 1,-0.2 4,-0.6 0.883 107.3 52.0 -59.7 -40.9 10.0 -7.2 -13.9 108 140 A K H ><5S+ 0 0 141 -4,-2.3 3,-0.7 3,-0.2 -1,-0.2 0.885 107.8 52.6 -58.8 -41.5 12.1 -4.0 -13.7 109 141 A Q H 3<5S+ 0 0 59 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.738 109.5 47.4 -70.5 -25.7 15.0 -6.0 -12.3 110 142 A I H 3<5S- 0 0 7 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.470 129.4 -93.0 -94.1 -3.5 14.9 -8.5 -15.3 111 143 A G T <<5 - 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